fixed xyz file reading error

GrupEstructuraElectronicaSimetria · Dec 16, 2020 · 2868f7b · 2868f7b
1 parent 91c9a7f
commit 2868f7b
Showing 1 changed file with 1 addition and 1 deletion.
diff --git a/cosymlib/file_io/__init__.py b/cosymlib/file_io/__init__.py
@@ -78,7 +78,7 @@ def get_geometry_from_file_xyz(file_name, read_multiple=False):
         if read_multiple:
             geometries.append(molecule)
         else:
-            return geometries[0]
+            return molecule
 
     return geometries