BN7OL0
-OEChem-04022101532D
30 30 0 1 0 0 0 0 0999 V2000
3.4311 -1.9216 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0
4.3321 -1.4877 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.9972 -2.8225 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.8650 -2.8225 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.8016 1.9963 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.3622 1.2448 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3076 -0.5127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5301 -1.4877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9311 0.2691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9311 0.2691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5546 -0.5127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5295 -0.2902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3650 1.1700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.8973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2355 2.8973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9210 -0.0280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7490 -0.7818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9101 -1.4877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3922 -2.0921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0690 0.8735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3725 0.5381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6675 -0.8947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1340 -0.1523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3915 0.3142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9537 -2.2790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3817 -2.9436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0463 -3.5155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7941 2.6282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5045 3.4559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6769 3.1663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
1 3 1 0 0 0 0
1 4 2 0 0 0 0
1 8 1 0 0 0 0
2 11 1 0 0 0 0
3 14 1 0 0 0 0
5 13 1 0 0 0 0
5 15 1 0 0 0 0
6 13 2 0 0 0 0
7 8 1 0 0 0 0
7 9 1 0 0 0 0
7 16 1 0 0 0 0
7 17 1 0 0 0 0
8 18 1 0 0 0 0
8 19 1 0 0 0 0
9 10 1 0 0 0 0
9 20 1 0 0 0 0
9 21 1 0 0 0 0
10 11 2 0 0 0 0
10 13 1 0 0 0 0
11 12 1 0 0 0 0
12 22 1 0 0 0 0
12 23 1 0 0 0 0
12 24 1 0 0 0 0
14 25 1 0 0 0 0
14 26 1 0 0 0 0
14 27 1 0 0 0 0
15 28 1 0 0 0 0
15 29 1 0 0 0 0
15 30 1 0 0 0 0
M END
$$$$