B13FVQ -OEChem-04042105353D 41 44 0 1 0 0 0 0 0999 V2000 4.7781 -3.6120 -0.0825 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.2042 -1.9289 -0.9931 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5164 2.5987 -0.5890 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4925 -0.8503 0.5536 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7579 -0.7335 1.6729 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7167 2.0798 0.3313 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4093 0.1962 -1.0353 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.5396 -0.2110 -0.1872 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9471 0.0992 -0.4318 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5344 1.4188 -0.3201 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2098 -0.7214 -0.8412 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8832 1.5611 -0.6394 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8092 -0.5490 -0.5879 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2706 -0.2645 -0.1608 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 -0.3428 1.2141 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4277 2.3813 0.0605 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1306 0.7939 0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4235 -0.6113 -1.9277 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7775 -1.5798 -0.2478 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4659 -0.1035 2.1649 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0413 3.8125 0.1986 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8724 -1.2653 0.6558 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4590 0.4912 0.5068 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1129 -1.8480 0.0413 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9540 -0.8113 0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6411 0.2206 -2.1047 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5583 -1.6523 -2.2386 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4018 -0.1194 -1.9379 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8078 -0.1144 -2.6828 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1240 0.9344 2.1224 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6202 -0.7684 1.9683 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7847 -0.2913 3.1966 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1301 -2.4005 -0.5437 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2675 3.9311 0.9635 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9002 4.4213 0.5015 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6773 4.2084 -0.7546 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0509 -2.0739 -0.0572 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0714 -1.6226 1.6697 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5057 -0.4035 0.4322 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1415 1.2853 0.8057 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0004 -0.9941 0.6497 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 11 2 0 0 0 0 3 12 2 0 0 0 0 4 5 1 0 0 0 0 4 13 1 0 0 0 0 4 22 1 0 0 0 0 5 15 2 0 0 0 0 6 16 1 0 0 0 0 6 17 2 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 7 12 1 0 0 0 0 7 26 1 0 0 0 0 8 13 2 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 2 0 0 0 0 10 12 1 0 0 0 0 10 16 2 0 0 0 0 13 18 1 0 0 0 0 14 17 1 0 0 0 0 14 19 1 0 0 0 0 15 20 1 0 0 0 0 16 21 1 0 0 0 0 17 23 1 0 0 0 0 18 27 1 0 0 0 0 18 28 1 0 0 0 0 18 29 1 0 0 0 0 19 24 2 0 0 0 0 19 33 1 0 0 0 0 20 30 1 0 0 0 0 20 31 1 0 0 0 0 20 32 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 25 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 25 41 1 0 0 0 0 M END $$$$