BT9B2G
-OEChem-04012112203D
49 51 0 0 0 0 0 0 0999 V2000
-1.1467 -1.3117 0.9142 O 0 0 0 0 0 0 0 0 0 0 0 0
7.1414 0.0426 -0.3888 O 0 0 0 0 0 0 0 0 0 0 0 0
6.5154 1.8587 0.8508 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2519 -0.5067 -0.2632 N 0 0 0 0 0 0 0 0 0 0 0 0
4.9049 0.5585 -0.2052 N 0 0 0 0 0 0 0 0 0 0 0 0
-6.2937 0.3777 -0.2156 N 0 0 0 0 0 0 0 0 0 0 0 0
-8.4722 0.2775 -0.6770 N 0 0 0 0 0 0 0 0 0 0 0 0
2.6396 0.4691 0.7665 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3989 -1.3509 -0.6305 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7788 1.3585 0.2691 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5577 -0.5013 -1.1542 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1373 -1.3301 0.2037 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0859 -0.4706 0.4804 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2141 0.8983 0.1444 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4212 -0.8933 0.6337 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5112 0.3236 -0.0791 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6970 0.4670 0.5536 C 0 0 0 0 0 0 0 0 0 0 0 0
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-3.9945 0.8928 0.2692 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7229 -1.4075 0.1485 C 0 0 0 0 0 0 0 0 0 0 0 0
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-6.7227 1.6756 -0.3277 C 0 0 0 0 0 0 0 0 0 0 0 0
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-8.0652 1.5866 -0.6121 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9449 -0.0406 1.6898 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8264 1.1558 1.0144 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7375 -1.9371 0.2342 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1083 -2.0590 -1.4157 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0995 2.0354 1.0679 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4456 1.9785 -0.5723 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2788 -0.0103 -2.0947 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4175 -1.1434 -1.3651 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4016 -1.9037 1.1023 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8694 -2.0717 -0.5603 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0844 0.2442 1.2894 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3437 0.0663 -0.4425 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6544 0.2878 1.0066 H 0 0 0 0 0 0 0 0 0 0 0 0
8.7714 1.3215 -0.4488 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9446 1.2289 0.7328 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2071 -2.8957 0.4963 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1567 1.9645 0.2247 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.4672 -2.1825 0.0009 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2439 -0.7028 -1.8303 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1289 -1.7192 -0.3994 H 0 0 0 0 0 0 0 0 0 0 0 0
10.4460 -0.5287 -0.5289 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.0949 2.5465 -0.2085 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.3717 -1.5038 -0.4141 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.7593 2.3985 -0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0
1 13 1 0 0 0 0
1 15 1 0 0 0 0
2 14 1 0 0 0 0
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3 14 2 0 0 0 0
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13 36 1 0 0 0 0
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15 17 2 0 0 0 0
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18 21 2 0 0 0 0
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22 44 1 0 0 0 0
22 45 1 0 0 0 0
22 46 1 0 0 0 0
23 25 2 0 0 0 0
23 47 1 0 0 0 0
24 48 1 0 0 0 0
25 49 1 0 0 0 0
M END
$$$$