B0FLY1
-OEChem-04022102162D
48 52 0 0 0 0 0 0 0999 V2000
7.2392 1.0813 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6701 -3.7852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.1701 1.7536 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.8611 0.8026 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.7392 -0.4575 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.7392 -0.4575 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.6701 0.2148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4791 0.8026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1701 1.7536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6701 -0.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5823 2.5626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4302 0.4936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5361 -1.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8041 -1.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9890 3.4762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5878 2.4581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5361 -2.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8041 -2.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0482 0.4936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6701 -2.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9993 0.8026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4013 4.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 3.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4067 4.1807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7424 0.1334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2072 1.7807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.6935 0.4425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.1582 2.0897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.9014 1.4206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8041 -4.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5345 2.2552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0730 -0.9752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2671 -0.9752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6056 3.5410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3356 1.8917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0730 -2.5952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2671 -2.5952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6534 4.8516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3834 3.2023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0423 4.6823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.6135 -0.4730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.7464 2.1956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.1542 0.0276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.2871 2.6962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.4910 1.6122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4941 -3.7483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2671 -4.5952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1141 -4.8222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 12 1 0 0 0 0
1 19 1 0 0 0 0
2 20 1 0 0 0 0
2 30 1 0 0 0 0
3 4 1 0 0 0 0
3 9 1 0 0 0 0
3 11 1 0 0 0 0
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10 13 2 0 0 0 0
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11 15 2 0 0 0 0
11 16 1 0 0 0 0
13 17 1 0 0 0 0
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16 23 2 0 0 0 0
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27 29 2 0 0 0 0
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28 29 1 0 0 0 0
28 44 1 0 0 0 0
29 45 1 0 0 0 0
30 46 1 0 0 0 0
30 47 1 0 0 0 0
30 48 1 0 0 0 0
M END
$$$$