BKCM19
-OEChem-04022105232D
44 47 0 0 0 0 0 0 0999 V2000
2.3176 -4.3220 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
5.9674 -1.5510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6318 3.8605 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3426 2.7038 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6783 -0.3943 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.6783 1.2152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2619 0.4105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.9105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.0895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9889 2.1657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2619 0.4105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 1.4105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.5895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9889 -1.3448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.9105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.0895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3211 -2.0891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7619 -0.4556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7619 1.2765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3211 2.9100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7619 -0.4556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7619 1.2765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6318 -3.0396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3426 -1.8829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.2619 0.4105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9639 -3.7839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6747 -2.6272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9854 -3.5777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5359 1.8737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3715 2.6536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 2.0305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.2095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 1.2205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -0.3995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4519 -0.9925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4519 1.8134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0719 -0.9925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0719 1.8134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2384 -3.1675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1500 -1.2936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.8819 0.4105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1565 -4.3732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0681 -2.4993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2177 4.3220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 28 1 0 0 0 0
2 14 2 0 0 0 0
3 20 1 0 0 0 0
3 44 1 0 0 0 0
4 20 2 0 0 0 0
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7 11 1 0 0 0 0
8 9 1 0 0 0 0
8 12 2 0 0 0 0
9 13 2 0 0 0 0
10 20 1 0 0 0 0
10 29 1 0 0 0 0
10 30 1 0 0 0 0
11 18 2 0 0 0 0
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12 15 1 0 0 0 0
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13 16 1 0 0 0 0
13 32 1 0 0 0 0
14 17 1 0 0 0 0
15 16 2 0 0 0 0
15 33 1 0 0 0 0
16 34 1 0 0 0 0
17 23 2 0 0 0 0
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18 21 1 0 0 0 0
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19 22 2 0 0 0 0
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22 25 1 0 0 0 0
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23 26 1 0 0 0 0
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24 27 2 0 0 0 0
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26 28 2 0 0 0 0
26 42 1 0 0 0 0
27 28 1 0 0 0 0
27 43 1 0 0 0 0
M END
$$$$