LKY98E -OEChem-05032301483D 32 34 0 0 0 0 0 0 0999 V2000 -7.5570 -2.2858 -0.0070 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.1201 1.9728 -0.0028 S 0 0 0 0 0 0 0 0 0 0 0 0 5.8133 1.7033 -0.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7552 2.5964 0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7891 1.6202 -0.0057 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6438 -0.2933 -0.0026 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6749 -0.6120 0.0018 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5984 -1.8157 0.0029 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6446 -2.9527 0.0071 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7166 0.6199 -0.0031 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9899 -0.5477 -0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5563 1.0208 -0.0051 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1429 0.6766 -0.0023 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2184 0.7277 0.0038 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7913 0.4920 0.0033 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9117 -1.7932 0.0042 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5889 1.3789 0.0065 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6354 -0.8941 -0.0021 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0696 1.0501 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7578 -1.7222 -0.0051 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1921 0.2220 0.0029 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0361 -1.1640 -0.0026 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9711 2.6151 -0.0069 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1108 0.1154 -0.8964 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1065 0.1179 0.9052 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6867 -0.7031 0.0028 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6613 -1.3724 -0.0038 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2172 2.1266 0.0104 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6196 -2.8004 -0.0093 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1812 0.6727 0.0049 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1914 -3.8599 0.0086 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6586 -2.9377 0.0077 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 2 12 1 0 0 0 0 2 14 1 0 0 0 0 3 13 2 0 0 0 0 4 17 2 0 0 0 0 5 10 1 0 0 0 0 5 12 1 0 0 0 0 5 23 1 0 0 0 0 6 11 1 0 0 0 0 6 12 2 0 0 0 0 7 13 1 0 0 0 0 7 16 1 0 0 0 0 7 26 1 0 0 0 0 8 11 1 0 0 0 0 8 16 2 0 0 0 0 9 16 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 14 17 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 15 17 1 0 0 0 0 15 18 2 0 0 0 0 15 19 1 0 0 0 0 18 20 1 0 0 0 0 18 27 1 0 0 0 0 19 21 2 0 0 0 0 19 28 1 0 0 0 0 20 22 2 0 0 0 0 20 29 1 0 0 0 0 21 22 1 0 0 0 0 21 30 1 0 0 0 0 M END $$$$