From 123279e7be4fe94ca5bcb08ca31ced5658914bed Mon Sep 17 00:00:00 2001
From: Calvin Pieters <calvinpieters@gmail.com>
Date: Mon, 31 Jul 2023 10:48:58 +0300
Subject: [PATCH] parser: Fixed elif statement in
 parse_normal_mode_displacement - changed bool argument

---
 .gitignore    | 4 ++++
 arc/parser.py | 4 ++--
 2 files changed, 6 insertions(+), 2 deletions(-)

diff --git a/.gitignore b/.gitignore
index 2cf4a8020c..4806aff914 100644
--- a/.gitignore
+++ b/.gitignore
@@ -53,6 +53,10 @@ timer.dat
 # .vscode
 .vscode
 
+# files created via testing
+nul
+run.out
+
 # .trunk folder
 .trunk
 
diff --git a/arc/parser.py b/arc/parser.py
index a39c5a92b2..fc005af31c 100644
--- a/arc/parser.py
+++ b/arc/parser.py
@@ -149,7 +149,7 @@ def parse_frequencies(path: str,
 
 def parse_normal_mode_displacement(path: str,
                                    software: Optional[str] = None,
-                                   raise_error: bool = True, # TODO: Why is this true? What is it supposed to do?
+                                   raise_error: bool = False, # TODO: Why is this true? What is it supposed to do?
                                    ) -> Tuple[np.ndarray, np.ndarray]:
     """
     Parse frequencies and normal mode displacement.
@@ -210,7 +210,7 @@ def parse_normal_mode_displacement(path: str,
                 parse_normal_mode_disp = True
             elif parse and not line or '-------------------' in line:
                 parse = False
-    if software == 'qchem':
+    elif software == 'qchem':
         number_freqs_per_line = 3
         parse, parse_normal_mode_disp = False, False
         for line in lines + ['']: