BP6V1X -OEChem-04022106363D 50 53 0 1 0 0 0 0 0999 V2000 4.9412 -2.6611 -0.2935 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.6189 -1.9639 1.8966 F 0 0 0 0 0 0 0 0 0 0 0 0 3.7515 1.7057 -0.8269 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0736 1.9610 -0.5999 N 0 0 2 0 0 0 0 0 0 0 0 0 -1.7500 1.3222 1.5332 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3691 1.3719 0.9897 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2287 2.5131 0.7334 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.3941 1.7196 1.8873 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8013 -0.0128 0.9054 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7039 -0.3623 -0.1116 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0556 0.5919 -0.8304 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7393 2.6547 0.9341 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1923 -0.2398 0.3212 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0094 2.8722 -1.7381 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5046 -1.7387 -0.3683 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9639 0.1144 -1.8015 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4096 -2.1773 -1.3214 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1414 -1.2484 -2.0432 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0282 -1.2168 0.8619 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6273 0.5317 -0.7564 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3565 0.9766 0.0823 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2994 -1.4219 0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8983 0.3264 -1.2931 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7343 -0.6504 -0.7526 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8820 -0.3852 0.2532 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9191 -1.1087 1.4801 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4071 -1.1125 -0.7923 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4707 -2.3615 1.3255 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 3.5231 0.7724 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1833 0.8528 2.2229 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4424 2.3839 2.7601 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6546 -0.7175 1.7372 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3293 1.3050 2.3732 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9442 3.1500 1.8899 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1823 3.2719 0.1458 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0254 3.0500 -2.0491 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5768 2.4819 -2.5906 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4521 3.8403 -1.4797 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0802 -2.4840 0.1773 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5637 0.8083 -2.3866 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1257 0.7494 1.7519 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5425 -3.2394 -1.5024 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8516 -1.5785 -2.7953 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9940 1.3007 -1.1898 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9500 -2.1827 0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2374 0.9278 -2.1315 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7239 -0.8101 -1.1705 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5732 -0.7434 2.4386 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5073 -0.8172 -1.8278 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6219 -3.1143 2.0863 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 19 1 0 0 0 0 3 21 2 0 0 0 0 4 7 1 0 0 0 0 4 11 1 0 0 0 0 4 14 1 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 5 33 1 0 0 0 0 6 12 1 0 0 0 0 6 21 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 7 29 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 16 2 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 19 1 0 0 0 0 13 20 2 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 17 1 0 0 0 0 15 39 1 0 0 0 0 16 18 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 43 1 0 0 0 0 19 22 2 0 0 0 0 20 23 1 0 0 0 0 20 44 1 0 0 0 0 21 25 1 0 0 0 0 22 24 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 26 28 2 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 M END $$$$