B58GCW -OEChem-04022109303D 29 31 0 0 0 0 0 0 0999 V2000 -2.1803 -1.9667 -0.0160 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5274 -1.9411 -0.0161 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5722 0.4921 0.0024 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6278 0.1446 0.0017 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8431 -0.6340 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5858 -0.7387 -0.0056 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5159 1.5292 0.0135 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0990 0.0005 0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7870 2.1370 0.0182 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0192 1.4102 0.0119 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4192 -0.1342 -0.0014 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1831 -0.5267 -0.0041 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1780 0.2812 0.0018 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2887 -1.2244 0.0314 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9292 1.1639 -0.0323 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6680 -1.0169 0.0328 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3085 1.3714 -0.0307 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0048 -0.3474 -0.0028 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5957 2.0966 0.0185 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0421 -0.5298 -0.0041 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7266 -2.8716 -0.0236 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8382 3.2255 0.0272 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9480 1.9799 0.0165 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9064 -2.2422 0.0558 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2641 2.0239 -0.0579 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3353 -1.8746 0.0582 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6936 2.3877 -0.0552 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2037 -0.2975 0.0273 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9419 1.4332 -0.0187 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 21 1 0 0 0 0 2 5 2 0 0 0 0 3 13 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 6 2 0 0 0 0 4 7 1 0 0 0 0 5 8 1 0 0 0 0 6 12 1 0 0 0 0 7 9 2 0 0 0 0 7 19 1 0 0 0 0 8 10 2 0 0 0 0 8 20 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 10 23 1 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 11 18 1 0 0 0 0 12 18 3 0 0 0 0 13 16 2 0 0 0 0 13 17 1 0 0 0 0 14 16 1 0 0 0 0 14 24 1 0 0 0 0 15 17 2 0 0 0 0 15 25 1 0 0 0 0 16 26 1 0 0 0 0 17 27 1 0 0 0 0 M END $$$$