B39QTD
-OEChem-04012113582D
61 63 0 1 0 0 0 0 0999 V2000
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8.7120 1.6642 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.9785 -2.7776 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.2120 0.7982 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
6.6284 1.6029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2712 -1.7014 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
5.6822 0.2982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6822 1.2982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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6.5819 -2.6519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.2120 0.7982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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4.8161 1.7982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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10.2120 0.7982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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11.2120 2.5302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.7120 1.6642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.4937 0.2458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
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6.3774 2.1698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0786 -1.1121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9752 -2.5241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8161 -0.8218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8161 2.4181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
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5.4526 -2.9822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5000 -3.8577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3755 -3.8103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4325 -3.4648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1670 -2.9860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6882 -2.2515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4132 -0.0118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4132 1.6082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4020 2.2011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8390 -2.6226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9250 -0.8901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1431 -0.4934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7464 -1.2754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1711 -3.3669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1279 -1.9647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3933 -2.4435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8721 -3.1780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.5220 0.2612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.5220 3.0671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.3320 1.6642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
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33 61 1 0 0 0 0
M END
$$$$