D0C5HP
-OEChem-10101305032D
26 27 0 0 0 0 0 0 0999 V2000
2.0000 0.0000 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 0.0000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 0.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 2.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7932 -1.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5991 -1.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -2.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -1.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 -1.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4651 -0.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 0.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 14 1 0 0 0 0
2 5 1 0 0 0 0
2 8 1 0 0 0 0
3 7 1 0 0 0 0
3 25 1 0 0 0 0
3 26 1 0 0 0 0
4 17 3 0 0 0 0
5 6 1 0 0 0 0
5 9 2 0 0 0 0
6 7 2 0 0 0 0
6 17 1 0 0 0 0
7 10 1 0 0 0 0
8 12 2 0 0 0 0
8 13 1 0 0 0 0
9 11 1 0 0 0 0
9 18 1 0 0 0 0
10 11 2 0 0 0 0
10 19 1 0 0 0 0
11 20 1 0 0 0 0
12 14 1 0 0 0 0
12 21 1 0 0 0 0
13 15 2 0 0 0 0
13 22 1 0 0 0 0
14 16 2 0 0 0 0
15 16 1 0 0 0 0
15 23 1 0 0 0 0
16 24 1 0 0 0 0
M END
$$$$