Changeset dab7ca for src/Element/elements_db.cpp

Timestamp:

Feb 4, 2015, 10:00:23 PM (10 years ago)

Author:

Frederik Heber <heber@…>

Children:

b5b114

Parents:

2e7afe

git-author:

Frederik Heber <heber@…> (08/26/13 22:07:18)

git-committer:

Frederik Heber <heber@…> (02/04/15 22:00:23)

Message:

tempcommit: Allow S-O bonds to be saturated.

• we don't have double bond info nor angle info. So this is just a test fix.

File:

• src/Element/elements_db.cpp (modified) (1 diff)

src/Element/elements_db.cpp

@@ -282 +282 @@
 14      0       120     109.47\n\
 15      0       -1      -1\n\
-16      0       -1      -1\n\
+16      0       104.5   -1\n\
 17      0 -1 -1\n\
 20      0       120     109.47\n\