BBV89X -OEChem-04042105363D 42 45 0 0 0 0 0 0 0999 V2000 -3.6236 -3.6606 -0.3373 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7553 -1.8792 0.6389 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1425 -1.2881 -0.0603 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0124 -0.3645 -0.1192 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3008 2.0100 0.0715 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2557 1.2032 0.2323 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1558 -1.4102 -1.1139 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6081 -2.5605 0.4441 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2222 -2.4138 -0.6894 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7571 -3.5020 0.7862 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3161 -0.1605 -0.0145 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9165 1.0745 0.1335 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0325 2.1597 0.1717 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7532 0.7510 -0.0691 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1789 0.5866 -0.1779 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5980 3.4211 0.3199 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9744 3.5835 0.4241 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7555 2.4486 0.3748 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7835 -0.5809 0.2879 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9560 1.5949 -0.7483 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1653 -0.7404 0.1832 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3379 1.4355 -0.8527 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9425 0.2678 -0.3872 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1723 -1.9757 0.5017 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6407 -0.4688 -1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6561 -1.7776 -2.0197 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9991 -2.4058 1.3427 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9752 -3.0127 -0.3296 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8101 -2.0381 0.1567 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9130 -2.5968 -1.5185 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3652 -4.4890 1.0513 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3348 -3.1329 1.6423 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9599 4.3016 0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2011 -1.3777 0.7455 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4154 4.5666 0.5396 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8358 2.5088 0.4504 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5141 2.5123 -1.1295 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9422 2.2201 -1.2989 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0197 0.2095 -0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4718 -2.9442 0.9155 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6866 -1.2055 1.0864 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4760 -1.9701 -0.5507 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 10 1 0 0 0 0 2 21 1 0 0 0 0 2 24 1 0 0 0 0 3 7 1 0 0 0 0 3 8 1 0 0 0 0 3 11 1 0 0 0 0 4 11 2 0 0 0 0 4 14 1 0 0 0 0 5 13 1 0 0 0 0 5 14 2 0 0 0 0 6 12 1 0 0 0 0 6 18 2 0 0 0 0 7 9 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 10 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 15 19 2 0 0 0 0 15 20 1 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 19 21 1 0 0 0 0 19 34 1 0 0 0 0 20 22 2 0 0 0 0 20 37 1 0 0 0 0 21 23 2 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 M END $$$$