B9KSA2
-OEChem-04022105573D
48 51 0 0 0 0 0 0 0999 V2000
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5.9579 1.6016 1.1690 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9988 -1.2007 1.0744 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.0012 -2.7585 2.2432 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.3166 -3.2786 1.0037 N 0 0 0 0 0 0 0 0 0 0 0 0
0.9851 -1.6955 -1.1669 N 0 0 0 0 0 0 0 0 0 0 0 0
1.0761 0.0293 -2.6671 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.5577 0.0288 0.7257 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4179 -1.5126 2.2660 C 0 0 0 0 0 0 0 0 0 0 0 0
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-3.9020 0.2675 0.9801 C 0 0 0 0 0 0 0 0 0 0 0 0
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-1.2944 -0.5643 3.3899 C 0 0 0 0 0 0 0 0 0 0 0 0
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-4.4610 1.4970 0.6315 C 0 0 0 0 0 0 0 0 0 0 0 0
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0.0440 -1.8248 -2.0677 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7136 0.0069 -0.8709 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5913 -0.5447 -1.5766 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9552 -0.3619 0.4525 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5624 0.9117 -1.5086 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8939 1.0789 0.5005 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0452 0.1740 1.1381 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6525 1.4476 -0.8229 C 0 0 0 0 0 0 0 0 0 0 0 0
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6.1466 1.1810 2.5193 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7091 0.8199 -0.0655 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5286 -0.4878 1.4475 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2381 -3.0187 -3.2571 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5921 -3.8272 -1.8317 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7966 -1.0428 4.2395 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6985 0.3084 3.1049 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2777 -0.2247 3.7296 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6505 2.9444 -0.6814 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.5125 1.6854 0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3055 -1.0604 0.9747 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4060 1.2151 -2.5409 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1736 -0.1542 2.1639 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3114 2.1508 -1.3251 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5447 4.9367 -0.2405 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9497 5.5283 -1.1204 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9718 4.2780 -1.8813 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3466 0.1060 2.5818 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3090 1.4851 3.1562 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0374 1.6942 2.8963 H 0 0 0 0 0 0 0 0 0 0 0 0
1 12 1 0 0 0 0
1 15 1 0 0 0 0
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3 19 1 0 0 0 0
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29 46 1 0 0 0 0
29 47 1 0 0 0 0
29 48 1 0 0 0 0
M END
$$$$