all_spacegroups.ipynb

{
 "cells": [
  {
   "cell_type": "code",
   "execution_count": 1,
   "metadata": {
    "scrolled": true
   },
   "outputs": [],
   "source": [
    "import pandas as pd\n",
    "#%run TensorScatteringClass # test class\n",
    "import TensorScatteringClass\n",
    "\n",
    "# loop through each sg and each wyckoff\n",
    "# if sg has glides or screw then loop through ref list for K=2 # record which ones are allowed/forbidden for K=2\n",
    "# extand to other tensors\n",
    "# figure out rules\n",
    "\n",
    "\n",
    "# quite soon - as VED (37 groups with no glides/screws: what are others called? Is he interested to participate?)\n",
    "\n"
   ]
  },
  {
   "cell_type": "code",
   "execution_count": 3,
   "metadata": {},
   "outputs": [
    {
     "name": "stdout",
     "output_type": "stream",
     "text": [
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 1\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.664 0.947 0.216\n",
      "       No. of spacegroup ops:  1\n",
      "      No. of sym ops at site:  1\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  1\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  -0.47+0.88i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 2\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  2\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  2\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 3\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.202 0.000\n",
      "       No. of spacegroup ops:  2\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  2\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 4\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.027 0.093 0.355\n",
      "       No. of spacegroup ops:  2\n",
      "      No. of sym ops at site:  1\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  2\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.89+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 5\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.357 0.000\n",
      "       No. of spacegroup ops:  4\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  2\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 6\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.829 0.000 0.561\n",
      "       No. of spacegroup ops:  2\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  2\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  -0.55+-0.84i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 7\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.013 0.261 0.953\n",
      "       No. of spacegroup ops:  2\n",
      "      No. of sym ops at site:  1\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  2\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.97+0.32i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 8\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.408 0.000 0.462\n",
      "       No. of spacegroup ops:  4\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  2\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  0.80+-1.83i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 9\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.002 0.232 0.204\n",
      "       No. of spacegroup ops:  4\n",
      "      No. of sym ops at site:  1\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  2\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+0.10i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 10\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  4\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 11\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  4\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 12\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 13\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  4\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  4\n"
     ]
    },
    {
     "name": "stdout",
     "output_type": "stream",
     "text": [
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 14\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  4\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 15\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 16\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  4\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 17\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.273 0.000 0.000\n",
      "       No. of spacegroup ops:  4\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  -1.92+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 18\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.217\n",
      "       No. of spacegroup ops:  4\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 19\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.573 0.504 0.413\n",
      "       No. of spacegroup ops:  4\n",
      "      No. of sym ops at site:  1\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.43+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 20\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.778 0.000 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  -3.75+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 21\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 22\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 23\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 24\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.188 0.000 0.250\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  -2.86+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 25\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.411\n",
      "       No. of spacegroup ops:  4\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  4\n"
     ]
    },
    {
     "name": "stdout",
     "output_type": "stream",
     "text": [
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 26\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.584 0.818\n",
      "       No. of spacegroup ops:  4\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 27\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.793\n",
      "       No. of spacegroup ops:  4\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 28\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.277\n",
      "       No. of spacegroup ops:  4\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 29\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.468 0.511 0.749\n",
      "       No. of spacegroup ops:  4\n",
      "      No. of sym ops at site:  1\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  3.68+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 30\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.197\n",
      "       No. of spacegroup ops:  4\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 31\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.134 0.727\n",
      "       No. of spacegroup ops:  4\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 32\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.958\n",
      "       No. of spacegroup ops:  4\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 33\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.350 0.818 0.449\n",
      "       No. of spacegroup ops:  4\n",
      "      No. of sym ops at site:  1\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  -1.26+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 34\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.339\n",
      "       No. of spacegroup ops:  4\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 35\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.500\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  4\n"
     ]
    },
    {
     "name": "stdout",
     "output_type": "stream",
     "text": [
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 36\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.098 0.275\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 37\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.250\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 38\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.797\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 39\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.737\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 40\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.746\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 41\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.302\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 42\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.362\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 43\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  8 a\n",
      "                 Site vector:  0.000 0.000 0.736\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  8\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  No\n",
      "   Structure factor for site:  0.00+0.00i\n",
      "          Spacegroup allowed:  No\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 44\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.101\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 45\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.678\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 46\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.809\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 47\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  8\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  8\n"
     ]
    },
    {
     "name": "stdout",
     "output_type": "stream",
     "text": [
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 48\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.250 0.250 0.250\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  -2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 49\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 50\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.250 0.250 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  -2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 51\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 52\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 53\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 54\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 55\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 56\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 57\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 58\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 59\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.250 0.250 0.201\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n"
     ]
    },
    {
     "name": "stdout",
     "output_type": "stream",
     "text": [
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  -2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 60\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 61\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 62\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 63\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 64\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 65\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  8\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 66\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.250\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 67\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.250 0.000 0.000\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  -4.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 68\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.250 0.250\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 69\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  32\n",
      "      No. of sym ops at site:  8\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 70\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  8 a\n",
      "                 Site vector:  0.125 0.125 0.125\n",
      "       No. of spacegroup ops:  32\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  8\n",
      "   No. of pg ops for crystal:  8\n"
     ]
    },
    {
     "name": "stdout",
     "output_type": "stream",
     "text": [
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  No\n",
      "   Structure factor for site:  0.00+0.00i\n",
      "          Spacegroup allowed:  No\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 71\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  8\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 72\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.250\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 73\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  8 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  8\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  8.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 74\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 75\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.668\n",
      "       No. of spacegroup ops:  4\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 76\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.932 0.314 0.356\n",
      "       No. of spacegroup ops:  4\n",
      "      No. of sym ops at site:  1\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  -0.07+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 77\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.517\n",
      "       No. of spacegroup ops:  4\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 78\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.963 0.554 0.846\n",
      "       No. of spacegroup ops:  4\n",
      "      No. of sym ops at site:  1\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  3.34+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 79\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.497\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 80\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.924\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 81\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  4\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  4\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 82\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  4\n"
     ]
    },
    {
     "name": "stdout",
     "output_type": "stream",
     "text": [
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 83\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  8\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 84\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 85\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.250 0.750 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  -2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 86\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.250 0.250 0.250\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  -2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 87\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  8\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 88\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.250 0.125\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 89\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  8\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 90\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 91\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.395 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.50+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 92\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.111 0.111 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  0.68+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 93\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 94\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n"
     ]
    },
    {
     "name": "stdout",
     "output_type": "stream",
     "text": [
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 95\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.346 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.29+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 96\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.456 0.456 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  3.39+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 97\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  8\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 98\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 99\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.020\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  8\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 100\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.063\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 101\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.393\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 102\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.253\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 103\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.780\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 104\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.255\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 105\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.931\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 106\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.982\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  8\n"
     ]
    },
    {
     "name": "stdout",
     "output_type": "stream",
     "text": [
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 107\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.182\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  8\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 108\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.847\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 109\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.111\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 110\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  8 a\n",
      "                 Site vector:  0.000 0.000 0.927\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  8\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  8.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 111\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  8\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 112\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.250\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 113\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 114\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 115\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  8\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 116\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.250\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 117\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 118\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  8\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n"
     ]
    },
    {
     "name": "stdout",
     "output_type": "stream",
     "text": [
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 119\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  8\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 120\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.250\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 121\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  8\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 122\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  8\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 123\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  16\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  16\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 124\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.250\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  8\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  16\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 125\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.250 0.250 0.000\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  8\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  16\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  -2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 126\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.250 0.250 0.250\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  8\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  16\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  -2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 127\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  8\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  16\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 128\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  8\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  16\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 129\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.750 0.250 0.000\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  8\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  16\n"
     ]
    },
    {
     "name": "stdout",
     "output_type": "stream",
     "text": [
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  -2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 130\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.750 0.250 0.250\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  16\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  -4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 131\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  8\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  16\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 132\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  8\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  16\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 133\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.250 0.250 0.000\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  16\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  -4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 134\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.250 0.750 0.250\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  8\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  16\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  -2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 135\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  16\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 136\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  8\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  16\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 137\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.750 0.250 0.750\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  8\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  16\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  -2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 138\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.750 0.250 0.000\n",
      "       No. of spacegroup ops:  16\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  16\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  -4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 139\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  32\n",
      "      No. of sym ops at site:  16\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  16\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 140\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.250\n",
      "       No. of spacegroup ops:  32\n",
      "      No. of sym ops at site:  8\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  16\n"
     ]
    },
    {
     "name": "stdout",
     "output_type": "stream",
     "text": [
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 141\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.750 0.125\n",
      "       No. of spacegroup ops:  32\n",
      "      No. of sym ops at site:  8\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  16\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 142\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  8 a\n",
      "                 Site vector:  0.000 0.250 0.375\n",
      "       No. of spacegroup ops:  32\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  8\n",
      "   No. of pg ops for crystal:  16\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  8.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 143\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.597\n",
      "       No. of spacegroup ops:  3\n",
      "      No. of sym ops at site:  3\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  3\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 144\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  3 a\n",
      "                 Site vector:  0.333 0.995 0.849\n",
      "       No. of spacegroup ops:  3\n",
      "      No. of sym ops at site:  1\n",
      " No. of equiv. sites in cell:  3\n",
      "   No. of pg ops for crystal:  3\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  0.04+0.08i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 145\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  3 a\n",
      "                 Site vector:  0.715 0.423 0.862\n",
      "       No. of spacegroup ops:  3\n",
      "      No. of sym ops at site:  1\n",
      " No. of equiv. sites in cell:  3\n",
      "   No. of pg ops for crystal:  3\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  -1.20+1.76i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 146\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  3 a\n",
      "                 Site vector:  0.000 0.000 0.320\n",
      "       No. of spacegroup ops:  9\n",
      "      No. of sym ops at site:  3\n",
      " No. of equiv. sites in cell:  3\n",
      "   No. of pg ops for crystal:  3\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  No\n",
      "   Structure factor for site:  0.00+0.00i\n",
      "          Spacegroup allowed:  No\n",
      "              Tensor allowed:  No\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 147\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  6\n",
      "      No. of sym ops at site:  6\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  6\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 148\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  3 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  18\n",
      "      No. of sym ops at site:  6\n",
      " No. of equiv. sites in cell:  3\n",
      "   No. of pg ops for crystal:  6\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  No\n",
      "   Structure factor for site:  0.00+0.00i\n",
      "          Spacegroup allowed:  No\n",
      "              Tensor allowed:  No\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 149\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  6\n",
      "      No. of sym ops at site:  6\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  6\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 150\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  6\n",
      "      No. of sym ops at site:  6\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  6\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 151\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  3 a\n",
      "                 Site vector:  0.349 0.651 0.333\n",
      "       No. of spacegroup ops:  6\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  3\n",
      "   No. of pg ops for crystal:  6\n"
     ]
    },
    {
     "name": "stdout",
     "output_type": "stream",
     "text": [
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  -1.43+-2.50i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 152\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  3 a\n",
      "                 Site vector:  0.263 0.000 0.333\n",
      "       No. of spacegroup ops:  6\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  3\n",
      "   No. of pg ops for crystal:  6\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  -0.97+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 153\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  3 a\n",
      "                 Site vector:  0.870 0.130 0.667\n",
      "       No. of spacegroup ops:  6\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  3\n",
      "   No. of pg ops for crystal:  6\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  -1.12+-2.13i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 154\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  3 a\n",
      "                 Site vector:  0.603 0.000 0.667\n",
      "       No. of spacegroup ops:  6\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  3\n",
      "   No. of pg ops for crystal:  6\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.55+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 155\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  3 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  18\n",
      "      No. of sym ops at site:  6\n",
      " No. of equiv. sites in cell:  3\n",
      "   No. of pg ops for crystal:  6\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  No\n",
      "   Structure factor for site:  0.00+0.00i\n",
      "          Spacegroup allowed:  No\n",
      "              Tensor allowed:  No\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 156\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.606\n",
      "       No. of spacegroup ops:  6\n",
      "      No. of sym ops at site:  6\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  6\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 157\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.683\n",
      "       No. of spacegroup ops:  6\n",
      "      No. of sym ops at site:  6\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  6\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 158\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.493\n",
      "       No. of spacegroup ops:  6\n",
      "      No. of sym ops at site:  3\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  6\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 159\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.740\n",
      "       No. of spacegroup ops:  6\n",
      "      No. of sym ops at site:  3\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  6\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 160\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  3 a\n",
      "                 Site vector:  0.000 0.000 0.958\n",
      "       No. of spacegroup ops:  18\n",
      "      No. of sym ops at site:  6\n",
      " No. of equiv. sites in cell:  3\n",
      "   No. of pg ops for crystal:  6\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  No\n",
      "   Structure factor for site:  0.00+0.00i\n",
      "          Spacegroup allowed:  No\n",
      "              Tensor allowed:  No\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 161\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  6 a\n",
      "                 Site vector:  0.000 0.000 0.703\n",
      "       No. of spacegroup ops:  18\n",
      "      No. of sym ops at site:  3\n",
      " No. of equiv. sites in cell:  6\n",
      "   No. of pg ops for crystal:  6\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  No\n",
      "   Structure factor for site:  0.00+0.00i\n",
      "          Spacegroup allowed:  No\n",
      "              Tensor allowed:  No\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 162\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  12\n",
      "      No. of sym ops at site:  12\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  12\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 163\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.250\n",
      "       No. of spacegroup ops:  12\n",
      "      No. of sym ops at site:  6\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  12\n"
     ]
    },
    {
     "name": "stdout",
     "output_type": "stream",
     "text": [
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 164\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  12\n",
      "      No. of sym ops at site:  12\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  12\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 165\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.250\n",
      "       No. of spacegroup ops:  12\n",
      "      No. of sym ops at site:  6\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  12\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 166\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  3 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  36\n",
      "      No. of sym ops at site:  12\n",
      " No. of equiv. sites in cell:  3\n",
      "   No. of pg ops for crystal:  12\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  No\n",
      "   Structure factor for site:  0.00+0.00i\n",
      "          Spacegroup allowed:  No\n",
      "              Tensor allowed:  No\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 167\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  6 a\n",
      "                 Site vector:  0.000 0.000 0.250\n",
      "       No. of spacegroup ops:  36\n",
      "      No. of sym ops at site:  6\n",
      " No. of equiv. sites in cell:  6\n",
      "   No. of pg ops for crystal:  12\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  No\n",
      "   Structure factor for site:  0.00+0.00i\n",
      "          Spacegroup allowed:  No\n",
      "              Tensor allowed:  No\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 168\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.428\n",
      "       No. of spacegroup ops:  6\n",
      "      No. of sym ops at site:  6\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  6\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 169\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  6 a\n",
      "                 Site vector:  0.492 0.394 0.789\n",
      "       No. of spacegroup ops:  6\n",
      "      No. of sym ops at site:  1\n",
      " No. of equiv. sites in cell:  6\n",
      "   No. of pg ops for crystal:  6\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  3.11+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 170\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  6 a\n",
      "                 Site vector:  0.270 0.379 0.198\n",
      "       No. of spacegroup ops:  6\n",
      "      No. of sym ops at site:  1\n",
      " No. of equiv. sites in cell:  6\n",
      "   No. of pg ops for crystal:  6\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  -1.43+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 171\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  3 a\n",
      "                 Site vector:  0.000 0.000 0.286\n",
      "       No. of spacegroup ops:  6\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  3\n",
      "   No. of pg ops for crystal:  6\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  3.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 172\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  3 a\n",
      "                 Site vector:  0.000 0.000 0.177\n",
      "       No. of spacegroup ops:  6\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  3\n",
      "   No. of pg ops for crystal:  6\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  3.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 173\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.584\n",
      "       No. of spacegroup ops:  6\n",
      "      No. of sym ops at site:  3\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  6\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 174\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  6\n",
      "      No. of sym ops at site:  6\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  6\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 175\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  12\n",
      "      No. of sym ops at site:  12\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  12\n"
     ]
    },
    {
     "name": "stdout",
     "output_type": "stream",
     "text": [
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 176\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.250\n",
      "       No. of spacegroup ops:  12\n",
      "      No. of sym ops at site:  6\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  12\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 177\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  12\n",
      "      No. of sym ops at site:  12\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  12\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 178\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  6 a\n",
      "                 Site vector:  0.468 0.000 0.000\n",
      "       No. of spacegroup ops:  12\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  6\n",
      "   No. of pg ops for crystal:  12\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  5.68+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 179\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  6 a\n",
      "                 Site vector:  0.934 0.000 0.000\n",
      "       No. of spacegroup ops:  12\n",
      "      No. of sym ops at site:  2\n",
      " No. of equiv. sites in cell:  6\n",
      "   No. of pg ops for crystal:  12\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.69+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 180\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  3 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  12\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  3\n",
      "   No. of pg ops for crystal:  12\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  3.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 181\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  3 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  12\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  3\n",
      "   No. of pg ops for crystal:  12\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  3.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 182\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  12\n",
      "      No. of sym ops at site:  6\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  12\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 183\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.166\n",
      "       No. of spacegroup ops:  12\n",
      "      No. of sym ops at site:  12\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  12\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 184\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.415\n",
      "       No. of spacegroup ops:  12\n",
      "      No. of sym ops at site:  6\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  12\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 185\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.807\n",
      "       No. of spacegroup ops:  12\n",
      "      No. of sym ops at site:  6\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  12\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 186\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.268\n",
      "       No. of spacegroup ops:  12\n",
      "      No. of sym ops at site:  6\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  12\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 187\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  12\n",
      "      No. of sym ops at site:  12\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  12\n"
     ]
    },
    {
     "name": "stdout",
     "output_type": "stream",
     "text": [
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 188\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  12\n",
      "      No. of sym ops at site:  6\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  12\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 189\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  12\n",
      "      No. of sym ops at site:  12\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  12\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 190\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  12\n",
      "      No. of sym ops at site:  6\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  12\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 191\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  24\n",
      "      No. of sym ops at site:  24\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  24\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 192\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.250\n",
      "       No. of spacegroup ops:  24\n",
      "      No. of sym ops at site:  12\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  24\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 193\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.250\n",
      "       No. of spacegroup ops:  24\n",
      "      No. of sym ops at site:  12\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  24\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 194\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  24\n",
      "      No. of sym ops at site:  12\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  24\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 195\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  12\n",
      "      No. of sym ops at site:  12\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  12\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 196\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  48\n",
      "      No. of sym ops at site:  12\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  12\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 197\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  24\n",
      "      No. of sym ops at site:  12\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  12\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 198\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.490 0.490 0.490\n",
      "       No. of spacegroup ops:  12\n",
      "      No. of sym ops at site:  3\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  12\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  3.97+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 199\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  8 a\n",
      "                 Site vector:  0.637 0.637 0.637\n",
      "       No. of spacegroup ops:  24\n",
      "      No. of sym ops at site:  3\n",
      " No. of equiv. sites in cell:  8\n",
      "   No. of pg ops for crystal:  12\n"
     ]
    },
    {
     "name": "stdout",
     "output_type": "stream",
     "text": [
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  -1.24+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 200\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  24\n",
      "      No. of sym ops at site:  24\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  24\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 201\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.250 0.250 0.250\n",
      "       No. of spacegroup ops:  24\n",
      "      No. of sym ops at site:  12\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  24\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  -2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 202\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  96\n",
      "      No. of sym ops at site:  24\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  24\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 203\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  8 a\n",
      "                 Site vector:  0.125 0.125 0.125\n",
      "       No. of spacegroup ops:  96\n",
      "      No. of sym ops at site:  12\n",
      " No. of equiv. sites in cell:  8\n",
      "   No. of pg ops for crystal:  24\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  No\n",
      "   Structure factor for site:  0.00+0.00i\n",
      "          Spacegroup allowed:  No\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 204\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  48\n",
      "      No. of sym ops at site:  24\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  24\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 205\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  24\n",
      "      No. of sym ops at site:  6\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  24\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 206\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  8 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  48\n",
      "      No. of sym ops at site:  6\n",
      " No. of equiv. sites in cell:  8\n",
      "   No. of pg ops for crystal:  24\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  8.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 207\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  24\n",
      "      No. of sym ops at site:  24\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  24\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 208\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  24\n",
      "      No. of sym ops at site:  12\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  24\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 209\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  96\n",
      "      No. of sym ops at site:  24\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  24\n"
     ]
    },
    {
     "name": "stdout",
     "output_type": "stream",
     "text": [
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 210\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  8 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  96\n",
      "      No. of sym ops at site:  12\n",
      " No. of equiv. sites in cell:  8\n",
      "   No. of pg ops for crystal:  24\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  No\n",
      "   Structure factor for site:  0.00+0.00i\n",
      "          Spacegroup allowed:  No\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 211\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  48\n",
      "      No. of sym ops at site:  24\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  24\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 212\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.125 0.125 0.125\n",
      "       No. of spacegroup ops:  24\n",
      "      No. of sym ops at site:  6\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  24\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  No\n",
      "   Structure factor for site:  0.00+0.00i\n",
      "          Spacegroup allowed:  No\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 213\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.375 0.375 0.375\n",
      "       No. of spacegroup ops:  24\n",
      "      No. of sym ops at site:  6\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  24\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  No\n",
      "   Structure factor for site:  0.00+0.00i\n",
      "          Spacegroup allowed:  No\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 214\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  8 a\n",
      "                 Site vector:  0.125 0.125 0.125\n",
      "       No. of spacegroup ops:  48\n",
      "      No. of sym ops at site:  6\n",
      " No. of equiv. sites in cell:  8\n",
      "   No. of pg ops for crystal:  24\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  No\n",
      "   Structure factor for site:  -0.00+0.00i\n",
      "          Spacegroup allowed:  No\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 215\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  24\n",
      "      No. of sym ops at site:  24\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  24\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 216\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  96\n",
      "      No. of sym ops at site:  24\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  24\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 217\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  48\n",
      "      No. of sym ops at site:  24\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  24\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 218\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  24\n",
      "      No. of sym ops at site:  12\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  24\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 219\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  8 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  96\n",
      "      No. of sym ops at site:  12\n",
      " No. of equiv. sites in cell:  8\n",
      "   No. of pg ops for crystal:  24\n"
     ]
    },
    {
     "name": "stdout",
     "output_type": "stream",
     "text": [
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  8.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 220\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  12 a\n",
      "                 Site vector:  0.375 0.000 0.250\n",
      "       No. of spacegroup ops:  48\n",
      "      No. of sym ops at site:  4\n",
      " No. of equiv. sites in cell:  12\n",
      "   No. of pg ops for crystal:  24\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  No\n",
      "   Structure factor for site:  0.00+-0.00i\n",
      "          Spacegroup allowed:  No\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 221\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  1 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  48\n",
      "      No. of sym ops at site:  48\n",
      " No. of equiv. sites in cell:  1\n",
      "   No. of pg ops for crystal:  48\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  1.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  False\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 222\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.250 0.250 0.250\n",
      "       No. of spacegroup ops:  48\n",
      "      No. of sym ops at site:  24\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  48\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  -2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 223\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  48\n",
      "      No. of sym ops at site:  24\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  48\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 224\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.250 0.250 0.250\n",
      "       No. of spacegroup ops:  48\n",
      "      No. of sym ops at site:  24\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  48\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  -2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 225\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  4 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  192\n",
      "      No. of sym ops at site:  48\n",
      " No. of equiv. sites in cell:  4\n",
      "   No. of pg ops for crystal:  48\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  4.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 226\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  8 a\n",
      "                 Site vector:  0.250 0.250 0.250\n",
      "       No. of spacegroup ops:  192\n",
      "      No. of sym ops at site:  24\n",
      " No. of equiv. sites in cell:  8\n",
      "   No. of pg ops for crystal:  48\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  -8.00+0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 227\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  8 a\n",
      "                 Site vector:  0.125 0.125 0.125\n",
      "       No. of spacegroup ops:  192\n",
      "      No. of sym ops at site:  24\n",
      " No. of equiv. sites in cell:  8\n",
      "   No. of pg ops for crystal:  48\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  No\n",
      "   Structure factor for site:  0.00+0.00i\n",
      "          Spacegroup allowed:  No\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 228\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  16 a\n",
      "                 Site vector:  0.125 0.125 0.125\n",
      "       No. of spacegroup ops:  192\n",
      "      No. of sym ops at site:  12\n",
      " No. of equiv. sites in cell:  16\n",
      "   No. of pg ops for crystal:  48\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  No\n",
      "   Structure factor for site:  -0.00+0.00i\n",
      "          Spacegroup allowed:  No\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Either\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 229\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  2 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  96\n",
      "      No. of sym ops at site:  48\n",
      " No. of equiv. sites in cell:  2\n",
      "   No. of pg ops for crystal:  48\n"
     ]
    },
    {
     "name": "stdout",
     "output_type": "stream",
     "text": [
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  Yes\n",
      "   Structure factor for site:  2.00+-0.00i\n",
      "          Spacegroup allowed:  Yes\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Crystal properties\n",
      "\n",
      "                    CIF file:  Spacegroup # 230\n",
      "                     Lattice:  0.500 0.500 0.500 90.00 90.00 90.00\n",
      "                   All sites:  \n",
      "               Site selected:  16 a\n",
      "                 Site vector:  0.000 0.000 0.000\n",
      "       No. of spacegroup ops:  96\n",
      "      No. of sym ops at site:  6\n",
      " No. of equiv. sites in cell:  16\n",
      "   No. of pg ops for crystal:  48\n",
      "\n",
      "Tensor properties\n",
      "\n",
      "             Required parity:  Even\n",
      "          Required time sym.:  Even\n",
      "                         hkl:  [2.0, 0.0, 0.0]\n",
      "                Site allowed:  No\n",
      "   Structure factor for site:  0.00+-0.00i\n",
      "          Spacegroup allowed:  No\n",
      "              Tensor allowed:  Yes\n",
      "                      Parity:  Even\n",
      "                        Time:  Either\n",
      "                          PT:  Either\n",
      "              Glide or screw:  True\n",
      "\n",
      "Total non-glide-screw:\t 37\n",
      "Total glide-screw:\t 193\n"
     ]
    }
   ],
   "source": [
    "n_glide_screw, n_non_glide_screw = 0, 0\n",
    "glide_screw, non_glide_screw = [], []\n",
    "\n",
    "for sg_no in range(1,230+1):\n",
    "    t=ten.TensorScatteringClass(spacegroup_number = sg_no, wyckoff_letter = 'a');\n",
    "    t.TensorCalc(hkl=np.array([2,0,0]), K=2, Parity=+1, Time=+1)\n",
    "    if t.glide_screw:\n",
    "        n_glide_screw += 1\n",
    "        glide_screw += [sg_no]\n",
    "    else:\n",
    "        n_non_glide_screw += 1\n",
    "        non_glide_screw += [sg_no]\n",
    "print('\\nTotal non-glide-screw:\\t %i\\nTotal glide-screw:\\t %i' % (n_non_glide_screw, n_glide_screw))\n",
    "#Total non-glide-screw:\t 37 # check VED: is it 37 and what are they called?\n",
    "#Total glide-screw:\t 193\n"
   ]
  },
  {
   "cell_type": "code",
   "execution_count": null,
   "metadata": {},
   "outputs": [],
   "source": []
  },
  {
   "cell_type": "code",
   "execution_count": 24,
   "metadata": {},
   "outputs": [],
   "source": [
    "reflist = []\n",
    "for h in range(6):\n",
    "    for k in range(6):\n",
    "        for l in range(6):\n",
    "            reflist += [[h, k, l]]\n",
    "reflist.sort(key = lambda x : x[0]**2 + x[1]**2 + x[2]**2)"
   ]
  },
  {
   "cell_type": "code",
   "execution_count": 25,
   "metadata": {},
   "outputs": [
    {
     "data": {
      "text/plain": [
       "[[0, 0, 0],\n",
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       " [1, 0, 0],\n",
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       " [1, 0, 1],\n",
       " [1, 1, 0],\n",
       " [1, 1, 1],\n",
       " [0, 0, 2],\n",
       " [0, 2, 0],\n",
       " [2, 0, 0],\n",
       " [0, 1, 2],\n",
       " [0, 2, 1],\n",
       " [1, 0, 2],\n",
       " [1, 2, 0],\n",
       " [2, 0, 1],\n",
       " [2, 1, 0],\n",
       " [1, 1, 2],\n",
       " [1, 2, 1],\n",
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       " [0, 2, 2],\n",
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       " [2, 2, 0],\n",
       " [0, 0, 3],\n",
       " [0, 3, 0],\n",
       " [1, 2, 2],\n",
       " [2, 1, 2],\n",
       " [2, 2, 1],\n",
       " [3, 0, 0],\n",
       " [0, 1, 3],\n",
       " [0, 3, 1],\n",
       " [1, 0, 3],\n",
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       " [3, 0, 1],\n",
       " [3, 1, 0],\n",
       " [1, 1, 3],\n",
       " [1, 3, 1],\n",
       " [3, 1, 1],\n",
       " [2, 2, 2],\n",
       " [0, 2, 3],\n",
       " [0, 3, 2],\n",
       " [2, 0, 3],\n",
       " [2, 3, 0],\n",
       " [3, 0, 2],\n",
       " [3, 2, 0],\n",
       " [1, 2, 3],\n",
       " [1, 3, 2],\n",
       " [2, 1, 3],\n",
       " [2, 3, 1],\n",
       " [3, 1, 2],\n",
       " [3, 2, 1],\n",
       " [0, 0, 4],\n",
       " [0, 4, 0],\n",
       " [4, 0, 0],\n",
       " [0, 1, 4],\n",
       " [0, 4, 1],\n",
       " [1, 0, 4],\n",
       " [1, 4, 0],\n",
       " [2, 2, 3],\n",
       " [2, 3, 2],\n",
       " [3, 2, 2],\n",
       " [4, 0, 1],\n",
       " [4, 1, 0],\n",
       " [0, 3, 3],\n",
       " [1, 1, 4],\n",
       " [1, 4, 1],\n",
       " [3, 0, 3],\n",
       " [3, 3, 0],\n",
       " [4, 1, 1],\n",
       " [1, 3, 3],\n",
       " [3, 1, 3],\n",
       " [3, 3, 1],\n",
       " [0, 2, 4],\n",
       " [0, 4, 2],\n",
       " [2, 0, 4],\n",
       " [2, 4, 0],\n",
       " [4, 0, 2],\n",
       " [4, 2, 0],\n",
       " [1, 2, 4],\n",
       " [1, 4, 2],\n",
       " [2, 1, 4],\n",
       " [2, 4, 1],\n",
       " [4, 1, 2],\n",
       " [4, 2, 1],\n",
       " [2, 3, 3],\n",
       " [3, 2, 3],\n",
       " [3, 3, 2],\n",
       " [2, 2, 4],\n",
       " [2, 4, 2],\n",
       " [4, 2, 2],\n",
       " [0, 0, 5],\n",
       " [0, 3, 4],\n",
       " [0, 4, 3],\n",
       " [0, 5, 0],\n",
       " [3, 0, 4],\n",
       " [3, 4, 0],\n",
       " [4, 0, 3],\n",
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       " [5, 0, 0],\n",
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       " [2, 3, 4],\n",
       " [2, 4, 3],\n",
       " [2, 5, 0],\n",
       " [3, 2, 4],\n",
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       " [4, 2, 3],\n",
       " [4, 3, 2],\n",
       " [5, 0, 2],\n",
       " [5, 2, 0],\n",
       " [1, 2, 5],\n",
       " [1, 5, 2],\n",
       " [2, 1, 5],\n",
       " [2, 5, 1],\n",
       " [5, 1, 2],\n",
       " [5, 2, 1],\n",
       " [0, 4, 4],\n",
       " [4, 0, 4],\n",
       " [4, 4, 0],\n",
       " [1, 4, 4],\n",
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       " [9, 9, 9]]"
      ]
     },
     "execution_count": 25,
     "metadata": {},
     "output_type": "execute_result"
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   ],
   "source": [
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   ]
  },
  {
   "cell_type": "code",
   "execution_count": 21,
   "metadata": {
    "collapsed": true
   },
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       " 192,\n",
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       " 194,\n",
       " 194,\n",
       " 194,\n",
       " 194,\n",
       " 198,\n",
       " 198,\n",
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       " 209,\n",
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       " 211,\n",
       " 226,\n",
       " 226,\n",
       " 226,\n",
       " 243]"
      ]
     },
     "execution_count": 21,
     "metadata": {},
     "output_type": "execute_result"
    }
   ],
   "source": [
    "lenlist.sort()\n",
    "lenlist\n",
    "\n",
    "def myFunc(e):\n",
    "  return len(e)\n",
    "\n",
    "cars = ['Ford', 'Mitsubishi', 'BMW', 'VW']\n",
    "\n",
    "cars.sort(key=myFunc)\n",
    "\n",
    "x = lambda a : a + 10\n",
    "print(x(5))"
   ]
  },
  {
   "cell_type": "code",
   "execution_count": 23,
   "metadata": {},
   "outputs": [
    {
     "data": {
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       " [7, 6, 9],\n",
       " [7, 9, 6],\n",
       " [9, 2, 9],\n",
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       " [6, 9, 9],\n",
       " [9, 6, 9],\n",
       " [9, 9, 6],\n",
       " [8, 8, 9],\n",
       " [8, 9, 8],\n",
       " [9, 8, 8],\n",
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       " [9, 7, 9],\n",
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       " [8, 9, 9],\n",
       " [9, 8, 9],\n",
       " [9, 9, 8],\n",
       " [9, 9, 9]]"
      ]
     },
     "execution_count": 23,
     "metadata": {},
     "output_type": "execute_result"
    }
   ],
   "source": [
    "reflist.sort(key = lambda x : x[0]**2 + x[1]**2 + x[2]**2)\n",
    "reflist"
   ]
  },
  {
   "cell_type": "code",
   "execution_count": 8,
   "metadata": {},
   "outputs": [
    {
     "data": {
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