B9UC3Y
-OEChem-04022105102D
31 33 0 0 0 0 0 0 0999 V2000
10.1279 1.8100 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
5.5443 1.0053 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.1900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.1900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.1900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 2.8100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 1.3100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1279 1.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5443 2.6147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1279 1.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6279 2.6760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6279 0.9440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6279 2.6760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6279 0.9440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.1279 1.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7369 3.2040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -0.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3179 3.2130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3179 0.4070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6540 -0.1074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2554 -0.7977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 2.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9379 3.2130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9379 0.4070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 20 1 0 0 0 0
2 8 1 0 0 0 0
2 9 1 0 0 0 0
3 21 1 0 0 0 0
3 31 1 0 0 0 0
4 21 2 0 0 0 0
5 12 1 0 0 0 0
5 16 1 0 0 0 0
5 23 1 0 0 0 0
6 10 1 0 0 0 0
6 17 2 0 0 0 0
7 12 2 0 0 0 0
7 17 1 0 0 0 0
8 10 2 0 0 0 0
8 12 1 0 0 0 0
9 11 2 0 0 0 0
9 13 1 0 0 0 0
10 11 1 0 0 0 0
11 22 1 0 0 0 0
13 14 2 0 0 0 0
13 15 1 0 0 0 0
14 18 1 0 0 0 0
14 24 1 0 0 0 0
15 19 2 0 0 0 0
15 25 1 0 0 0 0
16 21 1 0 0 0 0
16 26 1 0 0 0 0
16 27 1 0 0 0 0
17 28 1 0 0 0 0
18 20 2 0 0 0 0
18 29 1 0 0 0 0
19 20 1 0 0 0 0
19 30 1 0 0 0 0
M END
$$$$