BVLD90 -OEChem-04022101402D 44 46 0 1 0 0 0 0 0999 V2000 2.6810 0.3093 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9543 -1.3462 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 3.9160 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.0823 1.3274 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2634 -0.3952 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5724 -1.3462 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0313 -2.9340 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9013 3.0499 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8794 3.2578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9839 4.2524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0704 4.6591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4945 2.1364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4067 4.0205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.9340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6756 0.4138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2634 -0.3952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7634 -1.9340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7634 -2.9340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8973 -3.4340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6294 -3.4340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8973 -4.4340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6294 -4.4340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7634 -4.9340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2821 3.0175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9442 2.6412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4994 3.2578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5904 4.1235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1755 4.8420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3804 5.1960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5688 5.0235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9805 2.4831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0638 1.6904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8052 3.8705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 3.4020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6989 1.3922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5664 5.1862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7478 5.5004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4336 4.6819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1663 -3.1240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3604 -4.7440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1663 -4.7440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7634 -5.5540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4944 -3.2440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0313 -2.3140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 2 0 0 0 0 2 16 1 0 0 0 0 2 17 1 0 0 0 0 3 8 1 0 0 0 0 3 11 1 0 0 0 0 3 13 1 0 0 0 0 4 12 1 0 0 0 0 4 15 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 16 2 0 0 0 0 6 17 2 0 0 0 0 7 19 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 1 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 19 21 2 0 0 0 0 20 22 1 0 0 0 0 20 39 1 0 0 0 0 21 23 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 M END $$$$