adding fragment file for CCl4

This commit is contained in:
d3m299 2006-10-05 17:18:07 +00:00
parent a89133bb3b
commit 299e2b16d4

14
src/data/amber_u/CTT.frg Normal file
View file

@ -0,0 +1,14 @@
# Fragment file for flexible CCl4
$CCl
5 1 1 0
CCl
1 C CT 0 0 0 1 1 -0.388000 0.000000
2CL1 CL 0 0 0 1 1 0.097000 0.000000
3CL2 CL 0 0 0 1 1 0.097000 0.000000
4CL3 CL 0 0 0 1 1 0.097000 0.000000
5CL4 CL 0 0 0 1 1 0.097000 0.000000
1 2
1 3
1 4
1 5