D0L2KB -OEChem-04152110182D 40 43 0 1 0 0 0 0 0999 V2000 5.4777 3.5828 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8906 -2.1570 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0897 -0.9071 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6673 1.9000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6428 0.9250 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4295 -0.6702 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4447 0.9250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2994 0.4174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0475 1.0721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6576 1.9865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5438 0.4912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0438 2.6818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4203 1.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0438 2.6818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4078 -0.4936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9577 0.2047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 2.0393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6782 3.6572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1294 -1.1859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.0060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6494 3.8204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6122 -2.8493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3734 -3.8204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4077 0.0758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9285 -0.0794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7545 -0.0037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4045 0.5652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5891 1.3739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2503 2.1684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5390 2.5951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3432 0.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0071 1.5501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0704 4.1374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3866 3.0960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4252 4.3984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1794 -3.0996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9572 -2.3342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7714 -3.6723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2254 -4.4224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9755 -3.9684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 2 0 0 0 0 2 19 1 0 0 0 0 2 22 1 0 0 0 0 3 19 2 0 0 0 0 4 7 1 0 0 0 0 4 10 1 0 0 0 0 4 12 1 0 0 0 0 5 11 1 0 0 0 0 5 13 1 0 0 0 0 5 16 1 0 0 0 0 6 15 1 0 0 0 0 6 16 2 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 7 24 1 6 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 15 2 0 0 0 0 12 14 1 0 0 0 0 13 14 1 0 0 0 0 13 17 2 0 0 0 0 14 18 2 0 0 0 0 15 19 1 0 0 0 0 16 31 1 0 0 0 0 17 20 1 0 0 0 0 17 32 1 0 0 0 0 18 21 1 0 0 0 0 18 33 1 0 0 0 0 20 21 2 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 M END $$$$