Mol:
73 4.7100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.2577 2.3550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.6173 1.5700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8980 1.5700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8980 0.0000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
4.5384 2.3550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.1787 1.5700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5384 3.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1787 4.7100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 1 0 0 0 0
3 4 2 0 0 0 0
4 5 1 0 0 0 0
5 6 2 0 0 0 0
6 7 1 0 0 0 0
7 2 2 0 0 0 0
5 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 1 0 0 0 0
9 11 2 0 0 0 0
11 12 1 0 0 0 0
12 13 2 0 0 0 0
13 8 1 0 0 0 0
13 14 1 0 0 0 0
11 15 1 0 0 0 0
15 16 2 0 0 0 0
16 17 1 0 0 0 0
17 18 2 0 0 0 0
17 19 1 0 0 0 0
19 20 1 0 0 0 0
19 21 1 0 0 0 0
21 22 2 0 0 0 0
21 23 1 0 0 0 0
23 24 1 0 0 0 0
23 25 1 0 0 0 0
25 16 1 0 0 0 0
25 26 2 0 0 0 0
M END
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