Fixed

2017-08-12 15:22:50 +02:00 · 2017-08-12 15:22:50 +02:00 · 4de5b335da
parent f226634611
commit 4de5b335da
1 changed files with 1 additions and 1 deletions
--- 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: