B3INY4 -OEChem-04042106243D 44 47 0 1 0 0 0 0 0999 V2000 4.2555 0.1021 -1.9448 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3681 -0.8226 -2.5123 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.1856 -0.2481 -1.8422 F 0 0 0 0 0 0 0 0 0 0 0 0 -5.1048 -1.2681 -0.1401 F 0 0 0 0 0 0 0 0 0 0 0 0 -6.0190 0.5451 -0.9522 F 0 0 0 0 0 0 0 0 0 0 0 0 2.9720 -2.7150 0.5263 F 0 0 0 0 0 0 0 0 0 0 0 0 2.7357 2.4488 1.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0162 1.2370 -0.7802 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2212 -0.7845 0.5585 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5476 3.5141 -0.4795 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5458 0.0933 0.8348 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5328 1.3681 1.6130 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7430 1.0132 0.7933 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5803 -0.0404 -0.3169 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.0340 0.7666 0.2527 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6175 1.0807 1.6105 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5226 2.1604 0.5708 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5599 0.5460 0.1579 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4559 -0.9321 0.1284 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2656 -0.7046 -1.5138 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8538 -0.0694 -0.6911 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0971 2.3237 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1475 -0.4485 0.1368 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8985 -1.2741 0.5489 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7181 -2.2413 0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6363 -2.5834 0.9523 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 -3.0670 0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7276 -0.8183 1.3911 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6286 1.2952 2.6901 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6349 0.7014 1.3239 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9419 1.5870 -0.1027 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9508 1.1434 2.4623 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6030 0.6988 1.8498 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4477 2.5195 0.1368 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7905 2.9445 0.7279 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0365 1.2686 0.7978 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2404 0.7387 -0.8738 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7062 -1.6845 -1.3189 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9458 -1.4147 0.8849 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0746 0.5645 -0.1738 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4425 -3.2369 1.2756 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8767 -4.0862 1.2579 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0339 3.5989 -1.3498 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6363 4.3460 0.0936 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 20 1 0 0 0 0 3 21 1 0 0 0 0 4 21 1 0 0 0 0 5 21 1 0 0 0 0 6 25 1 0 0 0 0 7 12 1 0 0 0 0 7 22 1 0 0 0 0 8 14 1 0 0 0 0 8 22 2 0 0 0 0 9 18 1 0 0 0 0 9 24 1 0 0 0 0 9 39 1 0 0 0 0 10 22 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 19 1 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 23 1 0 0 0 0 19 25 2 0 0 0 0 20 38 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 26 1 0 0 0 0 25 27 1 0 0 0 0 26 27 2 0 0 0 0 26 41 1 0 0 0 0 27 42 1 0 0 0 0 M END $$$$