BN87SB -OEChem-04022106593D 31 33 0 1 0 0 0 0 0999 V2000 -4.2069 1.0848 0.4746 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7540 0.8998 -0.8457 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6271 0.3506 -0.0244 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0349 1.7797 0.3707 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6425 -1.6989 -0.3185 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0367 -1.2999 -0.0650 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9950 -0.1403 -0.2206 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6421 -0.5805 1.0962 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0916 -0.9954 0.8641 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8420 0.0880 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0820 0.4832 -1.1625 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5212 -0.3846 -0.0785 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 1.6429 0.2483 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5412 0.5202 0.1689 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8393 0.0198 0.1702 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9422 -2.0659 -0.2914 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5379 0.2962 -0.4834 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9229 -0.9831 -0.9203 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 -1.4044 1.5503 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6284 0.2521 1.8116 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1160 -1.9312 0.2924 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5857 -1.1897 1.8224 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9454 0.9674 0.7447 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8496 -0.2559 -0.1587 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5859 1.3218 -1.6537 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0421 -0.3448 -1.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9910 2.4414 0.3538 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1376 -3.1168 -0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7681 -0.6920 -0.0763 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2458 0.2014 -1.5327 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4366 0.9158 -0.4239 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 17 1 0 0 0 0 2 7 1 0 0 0 0 2 11 1 0 0 0 0 3 7 1 0 0 0 0 3 12 1 0 0 0 0 3 13 1 0 0 0 0 4 13 2 0 0 0 0 4 14 1 0 0 0 0 5 12 1 0 0 0 0 5 16 2 0 0 0 0 6 15 2 0 0 0 0 6 16 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 19 1 0 0 0 0 8 20 1 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 12 14 2 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 16 28 1 0 0 0 0 17 29 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 M END $$$$