From 4de5b335da1ae2883100e30a4cd634507e4b10b3 Mon Sep 17 00:00:00 2001 From: Anthony Scemama Date: Sat, 12 Aug 2017 15:22:50 +0200 Subject: [PATCH] Fixed --- resultsFile/Modules/gamessFile.py | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/resultsFile/Modules/gamessFile.py b/resultsFile/Modules/gamessFile.py index 0497295..1046d72 100755 --- a/resultsFile/Modules/gamessFile.py +++ b/resultsFile/Modules/gamessFile.py @@ -1368,7 +1368,7 @@ class gamessFile(resultsFile): pos += 1 ecp = {} try: - atom = line[0] + atom = int(line[0]) except: continue try: