B7BMA4 -OEChem-04042103503D 41 44 0 1 0 0 0 0 0999 V2000 5.7078 -0.4218 -2.1400 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.4920 -2.3602 0.3293 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.1438 3.8633 -0.3651 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1397 2.1526 -0.0960 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0622 1.6460 -0.4822 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0058 3.5229 -1.9235 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6623 1.5550 1.1314 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5149 0.7270 1.6359 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8513 0.6996 0.8497 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4416 0.8204 0.4465 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7392 -0.3848 -0.0209 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0720 0.9842 1.4546 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6731 0.0530 0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8494 -1.1994 -0.2975 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0907 -0.9099 0.3176 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7053 3.1469 -0.8079 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1852 0.1857 1.1912 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5179 0.1508 -0.7027 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0117 -0.7822 1.4677 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7549 -2.2948 -1.1711 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2009 -1.7242 0.0408 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8682 -3.0933 -1.4347 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0888 -2.8086 -0.8299 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7014 -0.5866 -0.7437 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1949 -1.5198 1.4265 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0398 -1.4218 0.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8982 2.3436 1.8563 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2635 -0.3023 1.9046 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9953 1.2216 2.4879 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7902 -0.6124 -0.5014 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1746 1.8183 2.1439 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1288 0.4255 1.6769 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2619 0.7993 -1.5376 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 -0.8832 2.3502 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8109 -2.5363 -1.6553 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1649 -1.5203 0.5023 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7816 -3.9376 -2.1124 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9551 -3.4307 -1.0355 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4443 -2.1647 2.2655 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8681 3.0747 -2.1773 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3402 4.2621 -2.5324 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 26 1 0 0 0 0 3 16 2 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 16 1 0 0 0 0 5 10 2 0 0 0 0 6 16 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 27 1 0 0 0 0 8 10 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 10 13 1 0 0 0 0 11 14 1 0 0 0 0 11 30 1 0 0 0 0 12 17 2 0 0 0 0 12 31 1 0 0 0 0 13 18 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 20 2 0 0 0 0 15 17 1 0 0 0 0 15 21 2 0 0 0 0 17 32 1 0 0 0 0 18 24 1 0 0 0 0 18 33 1 0 0 0 0 19 25 2 0 0 0 0 19 34 1 0 0 0 0 20 22 1 0 0 0 0 20 35 1 0 0 0 0 21 23 1 0 0 0 0 21 36 1 0 0 0 0 22 23 2 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 24 26 2 0 0 0 0 25 26 1 0 0 0 0 25 39 1 0 0 0 0 M END $$$$