BH9C3M
-OEChem-04022106083D
43 45 0 0 0 0 0 0 0999 V2000
1.5546 -4.9885 -0.1374 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-3.7969 2.9753 -0.0405 S 0 0 0 0 0 0 0 0 0 0 0 0
3.0957 0.2092 2.3343 F 0 0 0 0 0 0 0 0 0 0 0 0
4.1197 1.2129 -0.0151 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2559 3.7432 -1.1529 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.2383 2.8118 0.0916 O 0 0 0 0 0 0 0 0 0 0 0 0
4.3258 4.8075 -0.5382 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.2602 -2.3714 -0.1121 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.1088 -4.5868 -0.1495 N 0 0 0 0 0 0 0 0 0 0 0 0
0.0787 -2.6531 -0.1082 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8580 -1.1116 -0.0952 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1208 -1.6561 -0.0837 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0484 1.3980 -0.0612 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1012 -0.9508 0.5027 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2021 -0.0339 -0.6763 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6990 0.3093 0.5196 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7998 1.2264 -0.6594 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9320 -3.5619 -0.1369 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1448 -4.0285 -0.1311 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6161 -1.1947 1.1359 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6335 -1.1535 -1.2797 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1366 0.2719 -0.0365 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6240 -0.2305 1.1596 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6412 -0.1896 -1.2561 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2195 3.7183 1.4688 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8318 2.4670 -0.6317 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5968 3.5601 0.0892 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6271 -1.7705 0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3358 -0.0923 -1.3019 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6667 0.4233 1.0001 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2891 2.0547 -1.1427 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0106 -3.6463 -0.1646 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2270 -1.5758 2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2735 -1.5160 -2.2403 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0390 0.1851 -2.1953 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5476 3.1090 2.3131 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1304 3.7849 1.4375 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6517 4.7186 1.5409 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1306 2.4265 -1.6857 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7573 2.6925 -0.6022 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6755 3.3726 0.0705 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2935 3.6200 1.1393 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6314 4.7446 -1.4592 H 0 0 0 0 0 0 0 0 0 0 0 0
1 19 1 0 0 0 0
2 5 2 0 0 0 0
2 6 2 0 0 0 0
2 13 1 0 0 0 0
2 25 1 0 0 0 0
3 23 1 0 0 0 0
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4 26 1 0 0 0 0
7 27 1 0 0 0 0
7 43 1 0 0 0 0
8 10 1 0 0 0 0
8 11 1 0 0 0 0
8 18 1 0 0 0 0
9 18 2 0 0 0 0
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10 12 1 0 0 0 0
10 19 2 0 0 0 0
11 14 2 0 0 0 0
11 15 1 0 0 0 0
12 20 2 0 0 0 0
12 21 1 0 0 0 0
13 16 2 0 0 0 0
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14 16 1 0 0 0 0
14 28 1 0 0 0 0
15 17 2 0 0 0 0
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16 30 1 0 0 0 0
17 31 1 0 0 0 0
18 32 1 0 0 0 0
20 23 1 0 0 0 0
20 33 1 0 0 0 0
21 24 2 0 0 0 0
21 34 1 0 0 0 0
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22 24 1 0 0 0 0
24 35 1 0 0 0 0
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25 38 1 0 0 0 0
26 27 1 0 0 0 0
26 39 1 0 0 0 0
26 40 1 0 0 0 0
27 41 1 0 0 0 0
27 42 1 0 0 0 0
M END
$$$$