BBKU17 -OEChem-04022114443D 36 38 0 0 0 0 0 0 0999 V2000 -0.4840 0.9604 -1.7589 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1050 0.5239 -1.7911 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1598 1.7584 0.4281 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1620 0.7942 0.5081 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1354 -0.2177 0.2774 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7031 0.5999 0.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3802 0.4138 0.2315 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8224 1.9981 0.5961 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0769 -1.6146 0.1027 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 0.6965 -0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5741 -0.2847 0.0189 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2244 0.1248 0.6025 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5419 0.4447 -0.7066 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2629 -2.3264 -0.1109 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7018 -0.1317 0.4454 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4913 -1.6695 -0.1519 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1471 -1.4227 0.2035 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5918 0.9272 0.5455 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5139 -1.6602 0.0581 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9586 0.6897 0.4002 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4197 -0.6040 0.1564 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2909 1.3576 1.3095 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5056 -0.3847 1.0703 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4625 3.0040 0.7626 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8815 2.4657 0.4456 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1278 -2.1425 0.1302 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5308 0.2258 -0.0132 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0722 0.9605 1.2951 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7541 -0.7615 1.0427 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2238 -3.4039 -0.2468 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4001 -2.2420 -0.3192 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4498 -2.2517 0.1229 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2427 1.9386 0.7329 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8729 -2.6674 -0.1323 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6639 1.5121 0.4761 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4838 -0.7889 0.0429 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 2 0 0 0 0 2 13 2 0 0 0 0 3 7 1 0 0 0 0 3 8 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 2 0 0 0 0 5 7 1 0 0 0 0 5 9 2 0 0 0 0 6 10 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 7 11 2 0 0 0 0 8 24 1 0 0 0 0 9 14 1 0 0 0 0 9 26 1 0 0 0 0 10 13 1 0 0 0 0 11 16 1 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 14 16 2 0 0 0 0 14 30 1 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 16 31 1 0 0 0 0 17 19 1 0 0 0 0 17 32 1 0 0 0 0 18 20 2 0 0 0 0 18 33 1 0 0 0 0 19 21 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 36 1 0 0 0 0 M END $$$$