BC54SO -OEChem-04022103313D 36 38 0 0 0 0 0 0 0999 V2000 -2.8711 -2.4022 0.2246 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1818 1.4959 -1.2877 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7450 0.2923 0.8142 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7131 -1.6874 -1.7517 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2351 1.6883 -1.1657 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0581 -0.1712 -0.4531 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2245 0.0431 1.0292 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7619 0.3958 -0.5866 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5245 -0.1942 0.4244 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0369 -1.2593 -0.2499 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5828 1.7309 -1.1225 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9642 1.6241 0.3411 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5108 -0.1277 -0.9139 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0558 -1.3340 1.0783 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8106 -1.8646 0.7409 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2637 -1.8114 -0.5937 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0828 -2.5429 0.4809 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0259 -0.6722 0.3075 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4461 1.4040 1.0156 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4204 2.0082 0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3325 1.1799 -0.5096 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5011 2.2047 1.8637 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7984 2.7356 -1.4992 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1341 1.0089 -1.7376 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0257 1.8543 0.4751 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3824 2.3166 0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9172 0.3505 -1.6895 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6497 -1.8084 1.8548 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4744 -2.7581 1.2597 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8423 -2.1640 1.4786 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8133 -3.6032 0.4414 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6344 -0.8138 -0.9879 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5728 3.0809 0.3215 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4699 2.0536 1.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7125 3.2784 1.8214 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5722 1.8908 2.9104 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 8 1 0 0 0 0 2 11 1 0 0 0 0 3 9 1 0 0 0 0 3 12 1 0 0 0 0 4 16 2 0 0 0 0 5 21 2 0 0 0 0 6 18 1 0 0 0 0 6 21 1 0 0 0 0 6 32 1 0 0 0 0 7 18 2 0 0 0 0 7 19 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 14 1 0 0 0 0 10 13 2 0 0 0 0 10 15 1 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 12 25 1 0 0 0 0 12 26 1 0 0 0 0 13 27 1 0 0 0 0 14 15 2 0 0 0 0 14 28 1 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 M END $$$$