BK1BP5 -OEChem-04022111333D 42 44 0 0 0 0 0 0 0999 V2000 1.8543 -2.8087 -0.1587 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5277 3.1996 0.4181 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.9306 0.3223 0.3143 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7367 -2.1155 -0.3568 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4338 -0.7698 0.9692 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5899 -1.0419 -0.9323 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6311 -1.1803 0.0971 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8762 -0.3518 0.9227 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6002 0.0901 0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3560 0.5704 -1.0234 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9939 -0.9937 -0.1366 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4821 -1.8283 0.1917 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5017 0.7324 1.5613 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8692 0.9391 1.3412 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3459 -0.5062 -1.4418 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9641 1.9622 -1.1057 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1977 -2.0242 0.8015 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7579 -0.8128 0.1084 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4051 0.4502 0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9408 1.5487 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8007 1.3535 -1.1822 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0909 0.0502 -1.5521 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7246 3.2144 0.2077 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5085 0.5461 -1.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5465 -1.6683 -0.7802 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9413 -2.8816 -0.9843 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9421 1.3978 2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3628 1.7760 1.8299 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2129 -0.5192 -0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6983 -0.3461 -2.4653 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8909 -1.5000 -1.3832 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8132 2.0589 -0.4202 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3050 2.1899 -2.1202 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2304 2.7183 -0.8059 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9987 -2.7645 0.9089 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8545 -1.7926 1.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7461 0.5744 1.4092 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2395 2.1836 -1.7262 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7559 -0.1560 -2.3843 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 4.2218 0.4057 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2496 2.5236 0.9085 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4578 2.9359 -0.8154 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 17 1 0 0 0 0 2 20 1 0 0 0 0 2 23 1 0 0 0 0 3 9 1 0 0 0 0 3 10 1 0 0 0 0 4 7 1 0 0 0 0 4 12 1 0 0 0 0 4 26 1 0 0 0 0 5 8 1 0 0 0 0 5 12 2 0 0 0 0 6 18 2 0 0 0 0 6 22 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 13 1 0 0 0 0 9 11 2 0 0 0 0 9 14 1 0 0 0 0 10 15 1 0 0 0 0 10 16 1 0 0 0 0 10 24 1 0 0 0 0 11 25 1 0 0 0 0 13 14 2 0 0 0 0 13 27 1 0 0 0 0 14 28 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 M END $$$$