B6QU7B
-OEChem-04022103322D
31 32 0 0 0 0 0 0 0999 V2000
4.5981 0.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.6550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -2.6550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 3.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -1.1550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -2.6550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -2.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -3.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 1.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 2.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 -0.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6401 -1.1919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 -0.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0201 -0.1181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9781 -3.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -4.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2181 -3.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 0.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 0.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 2.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 2.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 3.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 8 2 0 0 0 0
2 9 2 0 0 0 0
3 10 2 0 0 0 0
4 19 1 0 0 0 0
4 31 1 0 0 0 0
5 8 1 0 0 0 0
5 10 1 0 0 0 0
5 13 1 0 0 0 0
6 9 1 0 0 0 0
6 10 1 0 0 0 0
6 14 1 0 0 0 0
7 8 1 0 0 0 0
7 9 1 0 0 0 0
7 11 2 0 0 0 0
11 12 1 0 0 0 0
11 20 1 0 0 0 0
12 15 2 0 0 0 0
12 16 1 0 0 0 0
13 21 1 0 0 0 0
13 22 1 0 0 0 0
13 23 1 0 0 0 0
14 24 1 0 0 0 0
14 25 1 0 0 0 0
14 26 1 0 0 0 0
15 17 1 0 0 0 0
15 27 1 0 0 0 0
16 18 2 0 0 0 0
16 28 1 0 0 0 0
17 19 2 0 0 0 0
17 29 1 0 0 0 0
18 19 1 0 0 0 0
18 30 1 0 0 0 0
M END
$$$$