BU4N3K -OEChem-04022115413D 35 37 0 0 0 0 0 0 0999 V2000 4.2110 -2.3622 1.5730 Br 0 0 0 0 0 0 0 0 0 0 0 0 -6.3593 0.2766 0.1371 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1180 -1.4650 -0.6730 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8596 -1.8253 -0.6577 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7286 0.9384 0.3363 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6571 2.1024 0.7325 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7092 0.7016 0.1451 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8553 -0.1882 -0.1201 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3613 1.0231 0.3422 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9717 -1.0167 -0.4092 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1107 -0.2969 -0.1192 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4593 -0.3190 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3182 0.7693 0.1971 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3194 1.9207 0.6392 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5072 -0.3734 -0.2722 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4737 -0.7066 -0.2469 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9732 -0.1300 -0.2405 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8406 -0.9158 0.5183 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4744 0.9251 -1.0027 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2092 -0.6465 0.5148 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8431 1.1946 -1.0061 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7105 0.4087 -0.2473 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7585 -0.0147 0.0546 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9427 -2.0296 -0.7884 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0693 -1.2593 -0.5535 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3567 1.6761 0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2607 2.7863 0.9516 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1949 1.5417 0.4526 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8143 1.5441 -1.6051 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9008 -1.2476 1.0996 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2336 2.0153 -1.6007 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7762 0.6185 -0.2504 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0370 -0.2297 -0.9812 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0053 -0.8595 0.7042 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3109 0.8654 0.3939 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 16 1 0 0 0 0 2 23 1 0 0 0 0 3 15 2 0 0 0 0 4 16 2 0 0 0 0 5 9 1 0 0 0 0 5 11 1 0 0 0 0 5 26 1 0 0 0 0 6 9 2 0 0 0 0 6 14 1 0 0 0 0 7 13 1 0 0 0 0 7 15 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 2 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 13 14 2 0 0 0 0 14 27 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 18 20 2 0 0 0 0 19 21 1 0 0 0 0 19 29 1 0 0 0 0 20 22 1 0 0 0 0 20 30 1 0 0 0 0 21 22 2 0 0 0 0 21 31 1 0 0 0 0 22 32 1 0 0 0 0 23 33 1 0 0 0 0 23 34 1 0 0 0 0 23 35 1 0 0 0 0 M END $$$$