diff --git a/resultsFile/Modules/gamessFile.py b/resultsFile/Modules/gamessFile.py index 4b4376f..bc4a93d 100755 --- a/resultsFile/Modules/gamessFile.py +++ b/resultsFile/Modules/gamessFile.py @@ -587,7 +587,10 @@ class gamessFile(resultsFile.resultsFileX): pos = self._pos line = self.text[pos].replace(',',' ').split() group = line[4] - self._point_group = group.replace('N',line[6]) + if "NAXIS=" in line: + self._point_group = group.replace('N',line[6]) + else: + self._point_group = group except IndexError: pass return self._point_group