BZJ12K
-OEChem-04012112572D
37 40 0 0 0 0 0 0 0999 V2000
9.0883 -1.5936 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.0000 1.4518 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5836 2.2565 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.2619 0.9518 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3958 2.4518 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.6051 -0.5200 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.9989 0.2847 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.1279 2.4518 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.0000 1.4518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.4518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0000 2.4518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0000 0.4518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5298 0.9518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5836 0.6471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5298 1.9518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3958 0.4518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2619 1.9518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5938 -0.6231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0938 -1.4891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6870 -2.4027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.4302 -3.0718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2962 -2.5718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 2.0718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3800 1.4518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.8318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6200 2.4518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0000 3.0718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3800 2.4518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3800 0.4518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0000 -0.1682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6200 0.4518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3910 0.0577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1279 3.0718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6648 2.1418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0806 -2.5316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3654 -3.6884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.8626 -2.8240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 19 1 0 0 0 0
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2 14 1 0 0 0 0
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14 32 1 0 0 0 0
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19 20 2 0 0 0 0
20 21 1 0 0 0 0
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21 22 2 0 0 0 0
21 36 1 0 0 0 0
22 37 1 0 0 0 0
M END
$$$$