BDV4S2
-OEChem-04022105272D
68 72 0 1 0 0 0 0 0999 V2000
10.6603 -1.0173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
11.5263 0.4827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -1.0173 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0
8.9282 -1.0173 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
8.0622 -0.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 -2.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 -2.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -2.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -0.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7942 -0.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -1.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.5263 -0.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.3923 -1.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.2583 -0.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.2583 0.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.3923 -2.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
14.1244 0.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
14.1244 -1.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.2583 -2.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
14.1244 1.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.3923 0.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
14.1244 -2.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
15.0183 0.4480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.2583 2.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.3923 1.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
15.0183 2.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
15.9244 0.9619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
15.9244 2.0035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.4651 -1.3273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4607 -0.0424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6636 -0.0424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1403 -2.5999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.5388 -1.9097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6636 -2.9923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4607 -2.9923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5856 -1.9097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9841 -2.5999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7287 -0.0424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9316 -0.0424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.1928 -0.0424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.3957 -0.0424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0656 -1.4923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8626 -1.4923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9966 -0.0424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1996 -0.0424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.1027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -2.3273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.8554 -2.3273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -0.7073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -3.1373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
14.6613 -0.7073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -2.3273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
13.2583 -3.1373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.8554 0.6727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
14.6613 -2.3273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
15.0111 -0.1720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
13.2583 3.1027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.8554 2.2927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
15.0111 3.1373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
16.4601 0.6498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
16.4601 2.3156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
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34 67 1 0 0 0 0
35 68 1 0 0 0 0
M END
$$$$