Timestamp:
Oct 11, 2008, 4:07:45 PM (17 years ago)
Author:
Frederik Heber <heber@…>
Children:
45d5cc
Parents:
1e5e16
Message:

corrected number of valence orbitals for Calcium (2 -> 4) and inserted typical bond distance and angle (first taken from bpti, second guessed)

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