B72FTY -OEChem-04022111223D 29 31 0 1 0 0 0 0 0999 V2000 3.1475 2.3387 -0.0077 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6998 1.4299 -0.0288 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9858 1.0007 0.2115 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0405 -1.2566 0.9013 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4389 -0.8943 0.3830 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1139 -2.6941 0.3857 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6193 -1.6613 -0.9386 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4561 -2.6437 -1.0244 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0138 -0.2899 0.4129 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6738 0.5940 0.1852 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6310 0.9849 -0.0351 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3790 -0.6169 0.4588 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6143 1.8850 -0.4717 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3463 0.2871 0.0202 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9634 1.5365 -0.4523 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0224 -1.2363 1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1850 -1.2670 1.0989 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1352 -3.0825 0.3963 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4975 -3.3691 0.9987 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5722 -2.2035 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6389 -1.0075 -1.8177 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7744 -3.6298 -1.3759 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2983 -2.2682 -1.7257 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7076 -1.5780 0.8445 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8022 0.4114 0.3211 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3299 2.8746 -0.8229 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3975 0.0165 0.0543 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7134 2.2447 -0.7916 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7221 2.5962 0.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 29 1 0 0 0 0 2 10 2 0 0 0 0 2 11 1 0 0 0 0 3 10 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 4 16 1 0 0 0 0 5 7 1 0 0 0 0 5 10 1 0 0 0 0 5 17 1 0 0 0 0 6 8 1 0 0 0 0 6 18 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 7 21 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 9 11 1 0 0 0 0 9 12 2 0 0 0 0 11 13 2 0 0 0 0 12 14 1 0 0 0 0 12 24 1 0 0 0 0 13 15 1 0 0 0 0 13 26 1 0 0 0 0 14 15 2 0 0 0 0 14 27 1 0 0 0 0 15 28 1 0 0 0 0 M END $$$$