BK4BH8
-OEChem-04012113592D
43 43 0 1 0 0 0 0 0999 V2000
6.3301 -0.0194 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.4806 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -1.0194 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.1752 1.4503 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2731 2.0684 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
5.9641 3.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6551 2.0684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9641 3.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 0.4806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -3.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -3.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2242 1.7594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.8994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -3.1394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.6394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3701 1.4560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5706 3.1483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8993 3.6360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0887 2.3205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3451 1.5314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0289 3.6360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3576 3.1483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -1.3294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3860 0.5632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9875 -0.1271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5560 -2.4825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 -3.3294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1760 -3.5564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2881 -3.5564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -3.3294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9081 -2.4825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6900 -0.9825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -1.8294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3100 -2.0564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4860 -0.0194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.6006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2460 -0.0194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 13 2 0 0 0 0
2 8 1 0 0 0 0
2 10 1 0 0 0 0
2 13 1 0 0 0 0
3 5 1 0 0 0 0
3 12 1 0 0 0 0
3 29 1 0 0 0 0
4 18 3 0 0 0 0
5 6 1 0 0 0 0
5 7 1 0 0 0 0
5 19 1 0 0 0 0
6 14 1 0 0 0 0
6 15 1 0 0 0 0
6 20 1 0 0 0 0
7 16 1 0 0 0 0
7 17 1 0 0 0 0
7 21 1 0 0 0 0
8 9 1 0 0 0 0
8 18 1 1 0 0 0
8 22 1 0 0 0 0
9 11 1 0 0 0 0
9 23 1 0 0 0 0
9 24 1 0 0 0 0
10 11 1 0 0 0 0
10 25 1 0 0 0 0
10 26 1 0 0 0 0
11 27 1 0 0 0 0
11 28 1 0 0 0 0
12 13 1 0 0 0 0
12 30 1 0 0 0 0
12 31 1 0 0 0 0
14 32 1 0 0 0 0
14 33 1 0 0 0 0
14 34 1 0 0 0 0
15 35 1 0 0 0 0
15 36 1 0 0 0 0
15 37 1 0 0 0 0
16 38 1 0 0 0 0
16 39 1 0 0 0 0
16 40 1 0 0 0 0
17 41 1 0 0 0 0
17 42 1 0 0 0 0
17 43 1 0 0 0 0
M END
$$$$