D00PVO -OEChem-10101305032D 42 45 0 1 0 0 0 0 0999 V2000 11.4371 -2.8251 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 7.0747 0.7437 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4782 1.7036 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -2.2909 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -0.7909 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9808 -0.8117 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 5.3147 2.7091 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 0.2091 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4487 -0.7909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 0.2091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0747 -1.3256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 0.7091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -1.2909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 0.7091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9808 0.2299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8448 -1.3151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 0.3024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 1.7091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 1.9115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.0455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8410 -2.3151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7128 -0.8184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0933 2.8251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7051 -2.8184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5769 -1.3217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5730 -2.3217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9118 -0.1009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8381 -0.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2366 -1.3735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6701 -1.7954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4683 -1.8046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5916 0.1238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1898 0.8136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5402 -0.3041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 0.9807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3029 -2.6230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7152 -0.1984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6597 3.0772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8411 3.3915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5269 2.5729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7027 -3.4384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1150 -1.0138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 2 10 1 0 0 0 0 2 15 1 0 0 0 0 3 14 1 0 0 0 0 3 19 1 0 0 0 0 4 13 2 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 5 13 1 0 0 0 0 6 11 1 0 0 0 0 6 15 1 0 0 0 0 6 16 1 0 0 0 0 7 18 3 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 8 14 1 0 0 0 0 8 27 1 0 0 0 0 9 13 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 12 2 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 18 1 0 0 0 0 14 17 2 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 21 2 0 0 0 0 16 22 1 0 0 0 0 17 20 1 0 0 0 0 17 34 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 35 1 0 0 0 0 21 24 1 0 0 0 0 21 36 1 0 0 0 0 22 25 2 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 26 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 M END $$$$