Rev 20 | Show entire file | Ignore whitespace | Details | Blame | Last modification | View Log | RSS feed
Rev 20 | Rev 16843 | ||
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1 | HEADER |
1 | HEADER |
2 | COMPND IO2F2 (exp) |
2 | COMPND IO2F2 (exp) |
3 |
|
3 | Gerard Dupuis |
4 | REMARK : |
4 | REMARK : cree a partir des longueurs de liaison exp. |
5 | 5 | ||
6 | 6 | ||
7 | ATOM 1 I 0.000 0.000 0.000 |
7 | ATOM 1 I 0.000 0.000 0.000 |
8 | ATOM 2 O 1,240 1,478 0,000 |
8 | ATOM 2 O 1,240 1,478 0,000 |
9 | ATOM 3 O 1,240 -1.478 0.000 |
9 | ATOM 3 O 1,240 -1.478 0.000 |
10 | ATOM 4 F 0.000 0,000 2.000 |
10 | ATOM 4 F 0.000 0,000 2.000 |
11 | ATOM 5 F 0,000 0,000 -2,000 |
11 | ATOM 5 F 0,000 0,000 -2,000 |
12 | 12 | ||
13 | 13 | ||
14 | CONECT 1 2 2 |
14 | CONECT 1 2 2 |
15 | CONECT 1 3 3 |
15 | CONECT 1 3 3 |