B5SAC9
-OEChem-04022103282D
25 26 0 0 0 0 0 0 0999 V2000
6.3301 -2.8450 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.1550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 3.1550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -2.8450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -1.3450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -2.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 2.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 -1.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 0.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 0.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -3.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -1.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 1.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 1.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 3.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 14 2 0 0 0 0
2 10 2 0 0 0 0
3 11 2 0 0 0 0
4 17 1 0 0 0 0
4 25 1 0 0 0 0
5 10 1 0 0 0 0
5 14 1 0 0 0 0
5 21 1 0 0 0 0
6 11 1 0 0 0 0
6 14 1 0 0 0 0
6 22 1 0 0 0 0
7 9 2 0 0 0 0
7 10 1 0 0 0 0
7 11 1 0 0 0 0
8 9 1 0 0 0 0
8 12 2 0 0 0 0
8 13 1 0 0 0 0
9 18 1 0 0 0 0
12 15 1 0 0 0 0
12 19 1 0 0 0 0
13 16 2 0 0 0 0
13 20 1 0 0 0 0
15 17 2 0 0 0 0
15 23 1 0 0 0 0
16 17 1 0 0 0 0
16 24 1 0 0 0 0
M END
$$$$