BITB59 -OEChem-04022103253D 35 37 0 0 0 0 0 0 0999 V2000 4.7466 2.1821 -0.1411 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2779 -3.5011 0.2931 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6432 2.7059 -1.6859 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9302 3.0758 0.6667 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1508 1.9719 0.1725 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9069 1.3449 -0.7652 O 0 5 0 0 0 0 0 0 0 0 0 0 -5.8839 -0.1037 -2.0591 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9708 -2.9861 -0.0833 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 -0.4348 0.5958 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4749 -0.9669 0.1428 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9177 0.6222 -1.0362 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0049 -0.7638 0.1092 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7971 -1.8865 -0.1403 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -1.2282 0.3172 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6117 0.5079 0.1092 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9852 0.6091 -0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1712 -1.8006 -0.3911 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6871 -2.5984 0.1926 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7511 -0.5288 -0.3861 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5945 -0.1657 0.4246 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6906 -0.1694 -0.4383 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6096 0.6336 1.5678 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8017 0.6260 -0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8168 1.4252 0.9852 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7206 1.4292 1.8479 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0058 1.3898 0.2949 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2708 -3.9407 -0.2252 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7677 -2.6859 -0.5846 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8166 -0.4531 -0.5884 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1098 -4.3809 0.1414 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 -0.8019 -1.3224 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7855 0.6504 2.2765 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0300 3.5970 -1.8545 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6652 2.0567 1.2362 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7343 2.0481 2.7405 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 16 1 0 0 0 0 2 18 1 0 0 0 0 2 30 1 0 0 0 0 3 33 1 0 0 0 0 6 11 1 0 0 0 0 7 11 2 0 0 0 0 8 13 1 0 0 0 0 8 18 1 0 0 0 0 8 27 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 20 1 0 0 0 0 11 23 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 13 17 1 0 0 0 0 14 18 2 0 0 0 0 15 16 2 0 0 0 0 15 26 1 0 0 0 0 16 19 1 0 0 0 0 17 19 2 0 0 0 0 17 28 1 0 0 0 0 19 29 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 21 31 1 0 0 0 0 22 25 2 0 0 0 0 22 32 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 34 1 0 0 0 0 25 35 1 0 0 0 0 M CHG 2 6 -1 11 1 M END $$$$