B8KJM4 -OEChem-04042107243D 33 35 0 1 0 0 0 0 0999 V2000 -2.4709 -3.3049 0.5927 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.1099 -0.4323 -0.9952 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4411 2.2346 1.3201 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6398 2.1042 -0.2717 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7848 -2.6393 -0.5633 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 -0.1147 -0.1780 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4840 1.8332 -0.4842 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8603 1.3570 -0.2519 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7068 -0.8102 0.2275 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2111 0.5090 -0.3778 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8868 0.9584 0.9087 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3477 0.9418 0.5038 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4203 -0.2842 -0.4011 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7510 -1.5624 0.3567 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3084 0.5239 -0.2344 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2983 -1.4455 0.0981 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3031 -0.4152 0.0097 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6550 -1.6592 0.2192 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6177 0.0487 -0.0062 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7931 2.1572 -0.4728 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0661 1.3371 -1.0824 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7088 0.2455 1.7222 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0345 0.9254 1.3548 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1256 -0.1494 -1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9993 -1.7975 1.1165 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7297 -1.4914 0.8403 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5334 -2.1311 0.1921 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6502 2.8685 0.6131 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5683 2.0388 -0.5534 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9116 -2.6892 -0.9886 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0214 3.1997 -0.6664 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5561 -1.7924 0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6444 -0.4326 0.2061 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 10 1 0 0 0 0 2 13 1 0 0 0 0 3 11 1 0 0 0 0 3 28 1 0 0 0 0 4 12 1 0 0 0 0 4 29 1 0 0 0 0 5 14 1 0 0 0 0 5 30 1 0 0 0 0 6 10 1 0 0 0 0 6 15 1 0 0 0 0 6 16 1 0 0 0 0 7 15 2 0 0 0 0 7 20 1 0 0 0 0 8 19 1 0 0 0 0 8 20 2 0 0 0 0 9 19 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 15 17 1 0 0 0 0 16 18 2 0 0 0 0 16 27 1 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 20 31 1 0 0 0 0 M END $$$$