BNH3E5 -OEChem-04022114263D 47 49 0 1 0 0 0 0 0999 V2000 -1.3188 -1.4192 -1.3636 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6966 3.1724 -0.5328 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2506 1.0589 0.5227 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1384 -1.5523 -2.7972 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4152 -2.0945 -0.6943 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7982 1.3759 -0.1359 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0109 -0.2216 1.6808 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3294 0.2306 -0.9427 N 0 0 1 0 0 0 0 0 0 0 0 0 -3.6172 -0.2142 1.5328 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2859 1.8569 -0.1692 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0032 1.9556 0.6504 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6416 0.5878 0.4640 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1799 1.0702 -1.4047 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1243 0.6377 0.5795 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9842 3.2498 -1.1343 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0187 1.7518 1.5001 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0368 3.5033 -0.0624 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2841 2.3090 0.8593 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1822 -1.9381 -0.5879 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1625 -2.4041 0.7268 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3866 -1.8792 -1.2891 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3473 -2.8111 1.3401 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5713 -2.2861 -0.6757 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5517 -2.7523 0.6388 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8184 -3.1876 1.2948 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 2.1584 1.7113 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6393 2.7673 0.2741 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1973 -0.1170 1.1697 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5702 1.7492 -2.1732 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6296 0.5075 -1.8637 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9634 4.1088 -1.8133 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2144 2.3637 -1.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3064 1.0112 2.2538 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4379 2.5285 2.0092 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9835 3.7767 -0.5426 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7245 4.3564 0.5527 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9824 2.6159 1.6465 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7729 1.5167 0.2788 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0796 -0.7405 2.2119 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7633 -2.4638 1.2916 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4283 -1.5383 -2.3194 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3189 -3.1744 2.3639 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5027 -2.2403 -1.2339 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2392 -0.9808 1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7823 -3.0173 2.3762 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6756 -2.6241 0.9107 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9887 -4.2533 1.1129 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 8 1 0 0 0 0 1 19 1 0 0 0 0 2 10 1 0 0 0 0 2 15 1 0 0 0 0 3 10 1 0 0 0 0 3 16 1 0 0 0 0 6 14 2 0 0 0 0 7 9 1 0 0 0 0 7 44 1 0 0 0 0 8 12 1 0 0 0 0 8 13 1 0 0 0 0 9 14 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 14 1 0 0 0 0 12 28 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 15 17 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 16 18 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 20 40 1 0 0 0 0 21 23 2 0 0 0 0 21 41 1 0 0 0 0 22 24 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 M END $$$$