B5DQG7
-OEChem-04012115322D
32 33 0 0 0 0 0 0 0999 V2000
5.5443 -2.7369 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
5.8550 -0.1769 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.4118 2.3428 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.7654 2.8809 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.9321 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.1279 -1.9321 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -1.4321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1441 0.9799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.9321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8335 0.0293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5443 -1.1274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -2.4321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1226 1.1861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.4321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.4321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.0679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.9321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.4333 2.1366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1236 1.5995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5303 1.0672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8540 -0.5903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4473 -0.0580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1432 0.5664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.7364 1.0987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 -1.1221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3520 0.0679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.6879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1120 0.0679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6900 -2.3952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -3.2421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3100 -3.4691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.6044 2.9321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 6 1 0 0 0 0
1 12 1 0 0 0 0
2 10 1 0 0 0 0
2 11 1 0 0 0 0
3 18 1 0 0 0 0
3 32 1 0 0 0 0
4 18 2 0 0 0 0
5 12 1 0 0 0 0
5 15 2 0 0 0 0
6 11 2 0 0 0 0
7 9 1 0 0 0 0
7 11 1 0 0 0 0
7 12 2 0 0 0 0
8 10 1 0 0 0 0
8 13 1 0 0 0 0
8 19 1 0 0 0 0
8 20 1 0 0 0 0
9 14 2 0 0 0 0
9 16 1 0 0 0 0
10 21 1 0 0 0 0
10 22 1 0 0 0 0
13 18 1 0 0 0 0
13 23 1 0 0 0 0
13 24 1 0 0 0 0
14 15 1 0 0 0 0
14 25 1 0 0 0 0
15 17 1 0 0 0 0
16 26 1 0 0 0 0
16 27 1 0 0 0 0
16 28 1 0 0 0 0
17 29 1 0 0 0 0
17 30 1 0 0 0 0
17 31 1 0 0 0 0
M END
$$$$