BF0B3H
-OEChem-04022104522D
44 47 0 0 0 0 0 0 0999 V2000
10.7282 4.1830 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
4.6660 -3.3170 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
4.6660 -0.3170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.1660 -4.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.1660 -4.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.2641 -1.8170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.5321 -2.8170 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3981 -0.3170 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.8000 -2.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8000 -1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5321 -1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6660 -1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9061 -3.3516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9061 -1.2823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3981 -1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.8378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.7962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2641 0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9962 1.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1301 -0.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2641 1.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.8622 1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9962 0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1301 1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.8622 2.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.7282 1.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.7282 3.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.5942 1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.5942 2.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0690 -3.1270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9132 -3.9716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9132 -0.6624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4643 -3.1499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4643 -1.4841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8612 -0.0070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1301 -0.9370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7272 1.4930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.5331 -0.1270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1301 2.3030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1291 -0.0070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.3252 2.9930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.7282 0.5630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.1312 1.3730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.1312 2.9930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 27 1 0 0 0 0
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2 9 1 0 0 0 0
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13 16 1 0 0 0 0
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14 17 1 0 0 0 0
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16 17 2 0 0 0 0
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18 20 2 0 0 0 0
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28 43 1 0 0 0 0
29 44 1 0 0 0 0
M END
$$$$