blob: 71ac077f9e93b68cc26888db326b22b77fca8b44 (
plain)
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
|
0 0 2
chloroform
CL3 INT 0
CORRECT OMIT DU BEG
0.0
1 DUMM DU M 0 0 0 0.
2 DUMM DU M 0 0 0 1.000
3 DUMM DU M 0 0 0 1.000 90.
4 H1 HZ M 0 0 0 1.0 90. 180. 0.2659
5 C1 CZ M 0 0 0 1.0 109.5 180. -.3847
6 CL1 CL E 0 0 0 1.4 109.5 60. 0.0396
7 CL2 CL E 0 0 0 1.4 109.5 -60. 0.0396
8 CL3 CL M 0 0 0 1.4 109.5 180. 0.0396
DONE
STOP
|
