B3P6NI
-OEChem-04022103072D
43 45 0 1 0 0 0 0 0999 V2000
2.0000 -0.7363 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.2637 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.1301 -0.2638 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
9.0421 -0.6740 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.2385 0.7304 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
9.2174 0.9345 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.2622 -0.7604 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
7.2583 -1.7604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3981 -0.2571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1224 -2.2637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3904 -2.2571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4920 -0.7709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.2363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3981 0.7846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.7637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4920 1.2984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.7363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 1.2637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.2363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.7637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7141 0.0666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.7363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 2.2637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7979 -1.0725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7964 -1.4525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.8104 -2.7995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6581 -2.5758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4345 -1.7280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0824 -1.7189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8522 -2.5650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6983 -2.7952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4848 -1.3909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9338 1.0966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4848 1.9184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.3563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 1.8837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.3304 -0.0006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3800 -1.7363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.3563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6200 -1.7363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6200 2.2637 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 2.8837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3800 2.2637 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 19 1 0 0 0 0
1 22 1 0 0 0 0
2 20 1 0 0 0 0
2 23 1 0 0 0 0
3 4 1 0 0 0 0
3 5 1 0 0 0 0
3 7 1 0 0 0 0
4 21 2 0 0 0 0
5 6 2 0 0 0 0
6 21 1 0 0 0 0
7 8 1 0 0 0 0
7 9 1 0 0 0 0
7 24 1 0 0 0 0
8 10 1 0 0 0 0
8 11 1 0 0 0 0
8 25 1 0 0 0 0
9 12 2 0 0 0 0
9 14 1 0 0 0 0
10 26 1 0 0 0 0
10 27 1 0 0 0 0
10 28 1 0 0 0 0
11 29 1 0 0 0 0
11 30 1 0 0 0 0
11 31 1 0 0 0 0
12 13 1 0 0 0 0
12 32 1 0 0 0 0
13 15 1 0 0 0 0
13 17 2 0 0 0 0
14 16 2 0 0 0 0
14 33 1 0 0 0 0
15 16 1 0 0 0 0
15 18 2 0 0 0 0
16 34 1 0 0 0 0
17 19 1 0 0 0 0
17 35 1 0 0 0 0
18 20 1 0 0 0 0
18 36 1 0 0 0 0
19 20 2 0 0 0 0
21 37 1 0 0 0 0
22 38 1 0 0 0 0
22 39 1 0 0 0 0
22 40 1 0 0 0 0
23 41 1 0 0 0 0
23 42 1 0 0 0 0
23 43 1 0 0 0 0
M END
$$$$