LB01NS -OEChem-05022323163D 40 43 0 0 0 0 0 0 0999 V2000 -7.4109 1.1907 -0.1475 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.9991 2.7220 0.7784 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9936 1.9229 -1.1028 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5744 -2.5302 0.2863 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7346 -1.5589 0.1699 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2779 -2.9034 0.3271 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5181 -0.6501 0.0691 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7750 -1.1855 0.1323 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3853 -1.7491 0.1936 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2112 0.6934 -0.0853 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0576 -0.2346 0.0178 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1035 -0.6257 0.0664 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1767 0.8670 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4855 0.0049 -0.0114 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7456 -0.4967 -1.1652 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7452 -0.2132 1.2341 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0738 0.8308 0.9463 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2725 -0.5902 -0.9974 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1411 1.7934 -0.2113 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2362 0.4667 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4492 1.0617 0.9181 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6478 -0.3592 -1.0258 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0296 0.0446 -1.2289 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0291 0.3282 1.1704 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6713 0.4570 -0.0611 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7065 0.7134 -0.0982 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5796 1.8715 -0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2768 -3.2546 0.3695 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2590 -0.8134 -2.0847 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2576 -0.3059 2.2018 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4797 1.2991 1.7277 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8315 -1.2341 -1.7549 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8965 1.7046 1.6716 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2505 -0.8293 -1.7985 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5159 0.1384 -2.1964 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5150 0.6452 2.0896 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2260 -0.0385 0.5041 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0934 0.6715 -1.1221 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9488 1.7067 0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6384 3.4595 0.6791 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 2 19 1 0 0 0 0 2 40 1 0 0 0 0 3 19 2 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 4 28 1 0 0 0 0 5 9 1 0 0 0 0 5 11 2 0 0 0 0 6 9 2 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 8 12 1 0 0 0 0 10 13 2 0 0 0 0 10 19 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 12 15 2 0 0 0 0 12 16 1 0 0 0 0 13 27 1 0 0 0 0 14 17 2 0 0 0 0 14 18 1 0 0 0 0 15 23 1 0 0 0 0 15 29 1 0 0 0 0 16 24 2 0 0 0 0 16 30 1 0 0 0 0 17 21 1 0 0 0 0 17 31 1 0 0 0 0 18 22 2 0 0 0 0 18 32 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 20 26 1 0 0 0 0 21 33 1 0 0 0 0 22 34 1 0 0 0 0 23 25 2 0 0 0 0 23 35 1 0 0 0 0 24 25 1 0 0 0 0 24 36 1 0 0 0 0 26 37 1 0 0 0 0 26 38 1 0 0 0 0 26 39 1 0 0 0 0 M END $$$$