BOV3I2 -OEChem-04022115423D 52 55 0 1 0 0 0 0 0999 V2000 -2.3328 4.3624 1.1250 Br 0 0 0 0 0 0 0 0 0 0 0 0 -2.5213 -3.3875 -0.9453 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.0387 -3.3774 1.8987 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.0165 2.6483 2.7065 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.1221 1.1671 -2.2696 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1768 4.0248 -1.8101 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2482 2.2461 -1.6569 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8434 -0.9594 -1.5397 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4753 -2.9084 -2.5976 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1126 1.7307 -0.1133 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1570 1.7450 1.8486 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8694 -4.2414 -0.2560 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 2.8702 -0.9954 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9550 1.7698 -1.3533 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3792 2.2403 -1.3344 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2856 1.1261 -2.5540 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7210 -0.3088 -2.7922 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4582 0.4256 0.1269 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5512 2.4799 0.9428 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1088 0.4608 1.3571 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2635 -0.7468 -0.6039 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2327 -2.2754 -1.5778 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6011 -0.7355 1.9059 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2844 -2.8401 -0.1683 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7598 -1.9281 -0.0429 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4171 -1.9247 1.1896 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7051 -2.7595 0.4064 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0347 -1.4032 0.9841 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6018 -0.4194 0.1739 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7720 -1.1343 2.3274 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9063 0.8330 0.7069 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0765 0.1181 2.8605 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6437 1.1017 2.0502 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1108 3.1816 0.0429 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0161 1.0919 -0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0795 2.9389 -1.8067 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4505 1.7057 -3.4707 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6987 -0.3153 -3.2878 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0108 -0.8360 -3.4148 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5007 4.6763 -1.5602 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5222 2.8319 -0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7930 -0.7877 -1.5727 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1110 -0.7240 2.8647 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5606 -2.3143 0.4651 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8357 -3.5011 1.2069 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4517 -3.0208 -0.3561 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8811 -4.6603 0.6733 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0979 -4.2912 -0.5748 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8149 -0.6168 -0.8732 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3276 -1.8914 2.9679 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3587 1.5865 0.0679 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8651 0.3140 3.9086 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 25 1 0 0 0 0 3 26 1 0 0 0 0 4 33 1 0 0 0 0 5 15 1 0 0 0 0 5 16 1 0 0 0 0 6 13 1 0 0 0 0 6 40 1 0 0 0 0 7 14 1 0 0 0 0 7 41 1 0 0 0 0 8 17 1 0 0 0 0 8 22 1 0 0 0 0 9 22 2 0 0 0 0 10 15 1 0 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0 11 19 2 0 0 0 0 11 20 1 0 0 0 0 12 24 1 0 0 0 0 12 47 1 0 0 0 0 12 48 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 34 1 0 0 0 0 14 16 1 0 0 0 0 14 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 20 1 0 0 0 0 18 21 2 0 0 0 0 20 23 2 0 0 0 0 21 25 1 0 0 0 0 21 42 1 0 0 0 0 22 24 1 0 0 0 0 23 26 1 0 0 0 0 23 43 1 0 0 0 0 24 27 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 29 31 1 0 0 0 0 29 49 1 0 0 0 0 30 32 2 0 0 0 0 30 50 1 0 0 0 0 31 33 2 0 0 0 0 31 51 1 0 0 0 0 32 33 1 0 0 0 0 32 52 1 0 0 0 0 M END $$$$