B18TNE -OEChem-04022108573D 29 30 0 0 0 0 0 0 0999 V2000 -1.2245 -2.1937 -0.1882 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9669 -3.4550 0.4814 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7075 -2.1895 -1.5557 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7013 0.6522 0.8492 O 0 5 0 0 0 0 0 0 0 0 0 0 4.0592 1.7862 -0.9173 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2533 -1.2318 0.8039 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8608 0.9031 -0.0481 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2864 -1.2730 -0.1461 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3974 0.1564 0.5032 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2152 -1.5468 0.8418 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5084 -0.2985 -1.1024 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6483 0.1651 -0.0811 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4061 -0.8214 0.8746 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6995 0.4266 -1.0696 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8988 0.5532 -0.7366 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0376 1.1160 1.4494 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0401 1.9095 -1.0302 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1789 2.4723 1.1558 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6802 2.8689 -0.0841 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2494 -1.4590 1.8069 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0414 -2.3047 1.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2119 -0.0839 -1.8851 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 -1.0508 1.6603 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8548 1.1866 -1.8311 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2136 -0.1722 -1.4803 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6440 0.8189 2.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4362 2.2185 -1.9931 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8982 3.2195 1.8923 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7914 3.9249 -0.3122 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 6 1 0 0 0 0 1 8 1 0 0 0 0 4 7 1 0 0 0 0 5 7 2 0 0 0 0 6 9 1 0 0 0 0 6 20 1 0 0 0 0 7 12 1 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 9 15 2 0 0 0 0 9 16 1 0 0 0 0 10 13 1 0 0 0 0 10 21 1 0 0 0 0 11 14 2 0 0 0 0 11 22 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 13 23 1 0 0 0 0 14 24 1 0 0 0 0 15 17 1 0 0 0 0 15 25 1 0 0 0 0 16 18 2 0 0 0 0 16 26 1 0 0 0 0 17 19 2 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 28 1 0 0 0 0 19 29 1 0 0 0 0 M CHG 2 4 -1 7 1 M END $$$$