BKWJ62 -OEChem-04022105163D 39 40 0 0 0 0 0 0 0999 V2000 -3.6175 0.1853 0.4311 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.7727 0.0899 -0.4513 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7271 -0.2928 1.8035 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7914 2.2781 -0.9863 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7246 -2.6990 1.7794 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1965 -2.9824 0.7577 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0851 1.8091 0.4590 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4829 1.7262 0.9074 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1542 -2.4451 -0.0117 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2849 -0.6341 -0.3444 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8471 2.1623 1.1681 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2397 -1.1481 0.4232 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2656 -0.7745 -1.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1754 -1.8025 -0.1966 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2011 -1.4289 -2.3519 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6769 2.0692 0.2171 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1561 -1.9429 -1.5843 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7814 1.5426 0.3755 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9144 -2.3386 0.6033 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8375 1.1963 1.2183 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0052 1.7077 -0.9913 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1175 1.0152 0.6943 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2851 1.5266 -1.5154 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3412 1.1803 -0.6726 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3836 2.4457 -0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9243 3.1986 1.5129 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7164 1.5288 2.0502 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2485 -1.0342 1.5043 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0648 -0.3761 -2.3505 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1876 -1.5406 -3.4322 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6439 -2.4648 -2.1015 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4122 1.5904 1.9134 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6765 1.0628 2.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2394 1.9726 -1.7065 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9395 0.7441 1.3502 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4605 1.6538 -2.5798 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3376 1.0383 -1.0807 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4067 -2.0909 -0.9275 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9285 -2.4030 0.4865 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 7 1 0 0 0 0 1 10 1 0 0 0 0 4 16 2 0 0 0 0 5 19 2 0 0 0 0 6 9 1 0 0 0 0 6 39 1 0 0 0 0 7 11 1 0 0 0 0 7 25 1 0 0 0 0 8 16 1 0 0 0 0 8 18 1 0 0 0 0 8 32 1 0 0 0 0 9 19 1 0 0 0 0 9 38 1 0 0 0 0 10 12 1 0 0 0 0 10 13 2 0 0 0 0 11 16 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 14 2 0 0 0 0 12 28 1 0 0 0 0 13 15 1 0 0 0 0 13 29 1 0 0 0 0 14 17 1 0 0 0 0 14 19 1 0 0 0 0 15 17 2 0 0 0 0 15 30 1 0 0 0 0 17 31 1 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 20 22 1 0 0 0 0 20 33 1 0 0 0 0 21 23 2 0 0 0 0 21 34 1 0 0 0 0 22 24 2 0 0 0 0 22 35 1 0 0 0 0 23 24 1 0 0 0 0 23 36 1 0 0 0 0 24 37 1 0 0 0 0 M END $$$$