D0T2KT
-OEChem-09301911213D
46 50 0 0 0 0 0 0 0999 V2000
4.4335 -0.7809 -1.8826 S 0 0 0 0 0 0 0 0 0 0 0 0
6.7188 2.0347 2.7866 F 0 0 0 0 0 0 0 0 0 0 0 0
2.3589 1.2576 -2.4451 O 0 0 0 0 0 0 0 0 0 0 0 0
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-0.9318 -2.9391 0.8785 N 0 0 0 0 0 0 0 0 0 0 0 0
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-4.8702 1.2792 0.3351 C 0 0 0 0 0 0 0 0 0 0 0 0
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2.7760 -0.8221 -1.3844 C 0 0 0 0 0 0 0 0 0 0 0 0
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1.8953 0.3266 -1.7843 C 0 0 0 0 0 0 0 0 0 0 0 0
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-4.9550 2.6891 0.1626 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3558 -2.8953 0.4839 C 0 0 0 0 0 0 0 0 0 0 0 0
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-6.2821 3.0112 -0.0058 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1226 0.0682 -0.4746 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2016 1.4609 -0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5827 -0.6602 0.6225 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7406 2.1251 0.6317 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1218 0.0041 1.7240 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2009 1.3968 1.7286 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8073 0.7836 0.6434 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9157 -2.6825 -0.3711 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3080 -2.7750 1.3066 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.4842 -0.9513 0.3364 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.6029 -2.5215 0.7046 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1341 3.3932 0.1615 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9533 -3.7467 0.7957 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.0129 1.7928 -0.0349 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1201 2.1091 -2.3092 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2004 0.9240 -2.2893 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7419 1.7971 -0.7901 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.7733 3.9608 -0.1648 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8530 2.0472 -1.3164 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5305 -1.7461 0.6374 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8031 3.2092 0.6355 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4803 -0.5624 2.5784 H 0 0 0 0 0 0 0 0 0 0 0 0
1 15 1 0 0 0 0
1 25 1 0 0 0 0
2 30 1 0 0 0 0
3 17 2 0 0 0 0
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29 46 1 0 0 0 0
M END
$$$$