BKD8B2 -OEChem-04022114423D 39 39 0 1 0 0 0 0 0999 V2000 -1.4640 -2.8038 0.2984 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6608 0.0323 0.1089 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4346 0.7235 -0.3435 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8741 -0.4385 0.3339 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9694 0.4457 -0.2684 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2309 -0.1429 -0.1865 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3416 2.0973 0.3753 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7590 -1.7572 -0.4258 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0689 1.7843 0.4628 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5094 -0.5457 -1.3103 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8268 -0.5508 1.0848 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0205 -1.7635 0.1084 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1997 2.9579 -0.1532 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3836 -1.3559 -1.1629 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7011 -1.3610 1.2323 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1327 2.6783 -0.1542 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5860 0.9364 -1.4104 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1058 -0.6291 1.3895 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9326 0.1207 0.3015 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7539 0.6238 -1.3292 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9333 -0.0750 -0.2172 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2223 1.9679 1.4579 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2789 2.6491 0.2262 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7042 -2.3074 -0.3695 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5461 -1.5836 -1.4854 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3081 1.6145 1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1029 2.3014 0.4279 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8114 -0.2379 -2.3078 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 -0.2507 1.9725 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2251 2.5060 0.0547 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2188 3.9416 0.3269 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2889 3.1076 -1.2339 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1584 -1.6636 -2.0534 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4009 -1.6690 2.2308 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8139 -0.7943 -0.4683 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4673 0.6369 -0.0436 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9036 2.8949 -1.2025 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1183 2.2041 -0.1084 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1878 3.6293 0.3849 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 12 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 6 1 0 0 0 0 3 7 1 0 0 0 0 3 17 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 18 1 0 0 0 0 4 19 1 0 0 0 0 5 9 1 0 0 0 0 5 20 1 0 0 0 0 5 21 1 0 0 0 0 6 10 2 0 0 0 0 6 11 1 0 0 0 0 7 13 1 0 0 0 0 7 22 1 0 0 0 0 7 23 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 16 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 14 1 0 0 0 0 10 28 1 0 0 0 0 11 15 2 0 0 0 0 11 29 1 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 M END $$$$