BH6VF3
-OEChem-04012114542D
72 75 0 0 0 0 0 0 0999 V2000
11.9895 -2.8830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.5900 3.7615 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
10.2651 -0.8763 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
13.7215 -2.8896 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.2358 2.6816 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
11.1369 0.6204 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.8231 0.0244 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.2246 -0.5350 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
14.7995 -4.0962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
15.3029 -3.2321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.8222 -3.8846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
14.6366 -2.4864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.8574 -2.3863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.8613 -1.3863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6123 3.4634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8705 1.7507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.9972 -0.8830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.7292 -0.8896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8481 2.0488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2246 2.8306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6235 3.3144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8816 1.6017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.0010 0.1170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4142 1.1478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8231 2.2713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6049 1.6478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.7331 0.1103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6049 0.6478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.8690 0.6137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8481 0.2469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.4049 0.6270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 4.0962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5163 0.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.4988 0.1132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.4988 2.1825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.2690 0.1237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.4049 1.6687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
14.6057 -4.6851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
15.3650 -4.3506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
15.8031 -3.5985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
15.7195 -2.7730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
13.2022 -3.8822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
13.7550 -4.5009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
15.1396 -2.1239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
14.3287 -1.9483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1568 3.7600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4149 4.0512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8550 1.1309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4782 1.6279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.4590 -1.1909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
14.2649 -1.2017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0790 3.0179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8210 2.7267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8971 2.2215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2739 1.7245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9295 1.5344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9295 0.7613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9610 2.8758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
14.2712 0.4183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.8714 1.2337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4847 4.4828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6134 4.5810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5153 3.7097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9392 0.8973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2898 0.0937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0934 0.4443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.1393 1.2404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4917 -0.5068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4917 2.8025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.9406 1.9807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6116 -0.4425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4512 -1.1121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 13 2 0 0 0 0
2 20 2 0 0 0 0
3 36 2 0 0 0 0
4 11 1 0 0 0 0
4 12 1 0 0 0 0
4 13 1 0 0 0 0
5 15 1 0 0 0 0
5 16 1 0 0 0 0
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6 23 1 0 0 0 0
6 36 1 0 0 0 0
6 67 1 0 0 0 0
7 28 1 0 0 0 0
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8 30 1 0 0 0 0
8 71 1 0 0 0 0
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10 41 1 0 0 0 0
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16 22 1 0 0 0 0
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28 34 1 0 0 0 0
29 60 1 0 0 0 0
31 34 2 0 0 0 0
31 36 1 0 0 0 0
31 37 1 0 0 0 0
32 61 1 0 0 0 0
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32 63 1 0 0 0 0
33 64 1 0 0 0 0
33 65 1 0 0 0 0
33 66 1 0 0 0 0
34 68 1 0 0 0 0
35 37 2 0 0 0 0
35 69 1 0 0 0 0
37 70 1 0 0 0 0
M END
$$$$