B7TK9D
-OEChem-04022103002D
57 61 0 1 0 0 0 0 0999 V2000
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8.9825 1.7151 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
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5.5443 1.7962 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.5443 0.1867 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.6279 0.1254 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
7.2212 -0.7881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.9643 -1.4572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.8303 -0.9572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1279 0.9915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2916 0.7641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.2697 0.5561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1279 0.9915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.5787 -0.3949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.5569 -0.6028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.4915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.4915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.2260 0.1403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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3.7320 1.9915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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13.5132 -1.0186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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2.8660 0.4915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
14.4913 -1.2266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
15.1604 -0.4834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
14.8003 -2.1776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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15.7785 -2.3855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
16.4476 -1.6424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.9656 0.6454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6842 -0.4781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8567 -1.2897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5036 -1.8721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3287 -1.9588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.0825 -1.5236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4200 -0.7656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.8837 0.6424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.2913 1.1758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.9648 -0.4812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.5571 -1.0145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7369 2.3855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.0344 0.7300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.4510 -2.0146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 2.6115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.6285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
13.6190 0.3932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
13.0356 -2.3514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
14.9689 0.1062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
14.3855 -2.6384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
16.5535 -0.2306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
15.9701 -2.9752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
17.0541 -1.7713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
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34 57 1 0 0 0 0
M END
$$$$