BV2MF8
-OEChem-04022101062D
44 45 0 1 0 0 0 0 0999 V2000
2.0000 -2.3746 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 0.1254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.5625 3.2567 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.6254 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.9641 3.8160 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -1.3746 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3651 2.0593 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
4.5631 2.0593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3406 3.0342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.1254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.8746 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
5.4641 0.6254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9641 3.8160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.5876 3.0342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.3746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1469 1.4358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.3746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.8746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -2.8746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -3.8746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -3.8746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -4.3746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2956 1.4432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9431 2.0593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4252 1.4548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9540 3.5189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7820 2.7652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3860 0.7080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9875 0.0177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -1.4946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1021 4.4205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4055 4.0850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5200 -0.7920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1215 -1.4823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7603 0.9510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6316 1.0492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5335 1.9205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2331 4.3746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -1.9946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -1.0646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -2.5646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 -4.1846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -4.1846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -4.9946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 18 1 0 0 0 0
2 12 2 0 0 0 0
3 14 2 0 0 0 0
4 7 1 0 0 0 0
4 8 1 0 0 0 0
4 12 1 0 0 0 0
5 13 1 0 0 0 0
5 14 1 0 0 0 0
5 38 1 0 0 0 0
11 6 1 6 0 0 0
6 39 1 0 0 0 0
6 40 1 0 0 0 0
7 14 1 0 0 0 0
7 16 1 1 0 0 0
7 23 1 0 0 0 0
8 9 1 0 0 0 0
8 24 1 0 0 0 0
8 25 1 0 0 0 0
9 13 1 0 0 0 0
9 26 1 0 0 0 0
9 27 1 0 0 0 0
10 11 1 0 0 0 0
10 12 1 0 0 0 0
10 28 1 0 0 0 0
10 29 1 0 0 0 0
11 15 1 0 0 0 0
11 30 1 0 0 0 0
13 31 1 0 0 0 0
13 32 1 0 0 0 0
15 17 1 0 0 0 0
15 33 1 0 0 0 0
15 34 1 0 0 0 0
16 35 1 0 0 0 0
16 36 1 0 0 0 0
16 37 1 0 0 0 0
17 18 1 0 0 0 0
17 19 2 0 0 0 0
18 20 2 0 0 0 0
19 21 1 0 0 0 0
19 41 1 0 0 0 0
20 22 1 0 0 0 0
20 42 1 0 0 0 0
21 22 2 0 0 0 0
21 43 1 0 0 0 0
22 44 1 0 0 0 0
M END
$$$$