BN4TI7 -OEChem-04042102443D 59 60 0 1 0 0 0 0 0999 V2000 3.2280 0.2535 -1.9185 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6783 4.6951 -0.2644 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9871 -3.3790 -0.8910 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8056 3.0117 0.2670 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0897 1.4824 -1.8066 N 0 0 1 0 0 0 0 0 0 0 0 0 1.5132 -0.6918 -0.6684 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0026 0.0141 2.9673 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0275 -3.0297 0.1619 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9148 2.0358 2.8579 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2306 1.6264 -2.4245 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1094 0.4237 -2.0843 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9418 0.6169 -2.6093 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3313 -1.3188 0.3387 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2838 0.2792 -0.5703 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7100 2.7970 -1.6266 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5963 -1.4593 1.6767 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0317 0.0492 -1.7234 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1794 -0.8816 -0.2203 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1497 -0.1319 2.2391 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7294 -2.6909 -0.1936 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0844 3.4750 -0.4332 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5557 -0.6893 -0.0993 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6317 -2.1482 -0.0173 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6951 1.1292 2.1852 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3842 -1.7637 0.2248 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4602 -3.2226 0.3067 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0963 1.3321 3.3169 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8365 -3.0303 0.4278 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6700 -4.2553 -0.2548 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1923 5.4708 0.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1514 1.7408 -3.5137 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7551 2.5222 -2.0692 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7023 -0.5010 -2.5093 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0902 0.5651 -2.5566 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4049 -0.2476 -3.0173 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3918 1.1413 -3.4613 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2336 -0.7074 0.4658 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7189 1.1975 -0.1557 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3248 0.1473 -0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7765 2.6971 -1.3917 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6017 3.4272 -2.5171 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2488 -1.9479 2.4111 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7204 -2.1103 1.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5147 -0.8747 -0.6497 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9946 0.2923 -0.2569 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5611 -2.3107 -0.1101 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6557 -0.7165 3.2035 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6092 1.4367 1.6981 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5567 -2.4088 0.7667 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4558 -1.6141 0.3186 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0337 -4.2088 0.4645 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9232 1.7111 3.9001 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4815 -3.8668 0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6924 -4.9360 0.5997 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6926 -4.0201 -0.5595 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1313 -4.7206 -1.0836 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7414 6.4159 0.8546 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3691 4.9432 1.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8728 5.6857 0.7068 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 2 0 0 0 0 2 21 1 0 0 0 0 2 30 1 0 0 0 0 3 20 2 0 0 0 0 4 21 2 0 0 0 0 5 10 1 0 0 0 0 5 12 1 0 0 0 0 5 15 1 0 0 0 0 6 13 1 0 0 0 0 6 17 1 0 0 0 0 6 44 1 0 0 0 0 7 19 1 0 0 0 0 7 27 1 0 0 0 0 7 47 1 0 0 0 0 8 20 1 0 0 0 0 8 29 1 0 0 0 0 8 49 1 0 0 0 0 9 24 1 0 0 0 0 9 27 2 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 14 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 17 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 16 1 0 0 0 0 13 20 1 0 0 0 0 13 37 1 0 0 0 0 14 18 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 21 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 19 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 18 22 2 0 0 0 0 18 23 1 0 0 0 0 19 24 2 0 0 0 0 22 25 1 0 0 0 0 22 45 1 0 0 0 0 23 26 2 0 0 0 0 23 46 1 0 0 0 0 24 48 1 0 0 0 0 25 28 2 0 0 0 0 25 50 1 0 0 0 0 26 28 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 30 59 1 0 0 0 0 M END $$$$