BK3PV2 -OEChem-04022103263D 37 39 0 1 0 0 0 0 0999 V2000 -2.1948 -0.2278 1.1174 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9871 2.4115 -0.1628 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5098 2.1859 -1.1942 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8293 -0.3984 2.1189 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8566 -0.3527 1.8267 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4546 -1.2057 -0.2839 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4804 -3.2135 -1.2326 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8863 0.6767 -0.7488 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8514 1.1975 0.4356 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8666 2.7962 -0.9530 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3636 1.1310 -0.6686 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9976 0.0531 0.3558 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8715 1.0025 -0.7655 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.2508 0.6305 0.6564 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.5826 -0.0917 0.7579 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8518 -1.5176 -0.5352 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2173 -2.2534 -0.7196 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8105 -2.7610 -1.1207 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9386 -0.5770 -0.1781 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8871 -0.9794 0.6855 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9646 -0.0334 1.0483 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8258 1.5268 -0.4396 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8791 1.0127 -1.6429 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2369 0.3777 1.0734 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1299 0.1887 -1.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2653 1.5114 1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5609 -1.0354 0.2033 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3993 0.5318 0.3818 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0183 2.4165 -0.0795 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1358 2.4212 -2.0603 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2958 -2.2667 -0.6435 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6425 -3.3561 -1.4694 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6846 -0.8593 2.1585 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9054 -1.9668 1.1328 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5561 1.9003 0.6381 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1568 3.1241 -1.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6043 3.4451 -0.7019 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 14 1 0 0 0 0 2 11 1 0 0 0 0 2 29 1 0 0 0 0 3 13 1 0 0 0 0 3 30 1 0 0 0 0 4 15 1 0 0 0 0 4 33 1 0 0 0 0 5 21 2 0 0 0 0 6 12 1 0 0 0 0 6 16 1 0 0 0 0 6 17 1 0 0 0 0 7 17 2 0 0 0 0 7 18 1 0 0 0 0 8 19 1 0 0 0 0 8 22 2 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 9 35 1 0 0 0 0 10 22 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 23 1 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 17 31 1 0 0 0 0 18 32 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 M END $$$$