D03BHM
-OEChem-04152110592D
33 35 0 0 0 0 0 0 0999 V2000
11.5942 -0.2673 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0
10.7282 1.2327 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6660 -0.2673 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
10.7282 0.2327 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0
3.8000 1.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8000 0.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5321 0.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6660 1.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1301 -0.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5321 1.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9061 1.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3981 -0.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9061 -0.3020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2641 0.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9962 0.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1301 -1.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.2535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.2119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.8622 -0.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9962 -1.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.8622 -1.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6660 2.3527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0690 1.5427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9132 2.3873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3981 -0.8873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9132 -0.9220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2641 0.8527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9962 0.8527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5932 -1.5773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4643 1.5656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4643 -0.1002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9962 -2.3873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.3991 -1.5773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 4 1 0 0 0 0
2 4 2 0 0 0 0
3 6 1 0 0 0 0
3 7 2 0 0 0 0
4 19 1 0 0 0 0
5 6 1 0 0 0 0
5 8 1 0 0 0 0
5 11 2 0 0 0 0
6 13 2 0 0 0 0
7 10 1 0 0 0 0
7 12 1 0 0 0 0
8 10 2 0 0 0 0
8 22 1 0 0 0 0
9 14 1 0 0 0 0
9 15 2 0 0 0 0
9 16 1 0 0 0 0
10 23 1 0 0 0 0
11 17 1 0 0 0 0
11 24 1 0 0 0 0
12 14 2 0 0 0 0
12 25 1 0 0 0 0
13 18 1 0 0 0 0
13 26 1 0 0 0 0
14 27 1 0 0 0 0
15 19 1 0 0 0 0
15 28 1 0 0 0 0
16 20 2 0 0 0 0
16 29 1 0 0 0 0
17 18 2 0 0 0 0
17 30 1 0 0 0 0
18 31 1 0 0 0 0
19 21 2 0 0 0 0
20 21 1 0 0 0 0
20 32 1 0 0 0 0
21 33 1 0 0 0 0
M CHG 2 1 -1 4 1
M END
$$$$