B2VXQ3 -OEChem-04022108183D 26 27 0 0 0 0 0 0 0999 V2000 1.8853 -2.3735 0.6758 S 0 0 0 0 0 0 0 0 0 0 0 0 1.7745 0.1375 -0.5474 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3463 -0.0942 1.0375 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6909 -0.0323 -1.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6522 0.0248 -0.8248 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5183 -1.0658 -0.9058 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0354 1.1692 -0.1254 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3113 -0.7989 0.3759 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4750 1.3211 -0.4146 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1504 0.1327 0.4121 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7673 -1.0118 -0.2874 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2845 1.2232 0.4929 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4111 1.1782 0.5316 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4864 0.1900 1.0728 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8319 -1.0017 -1.9856 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7508 0.7349 -2.2746 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2352 -1.9638 -1.4483 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3794 2.0325 -0.0599 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2495 2.1887 -1.0136 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4326 -1.8683 -0.3563 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5719 2.1206 1.0343 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9492 -0.4549 1.7666 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1327 1.8903 0.8947 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4152 -0.1888 2.0972 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8682 1.2161 1.1038 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2231 -0.4092 0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 2 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 2 9 1 0 0 0 0 3 8 1 0 0 0 0 3 13 1 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 15 1 0 0 0 0 4 16 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 6 11 1 0 0 0 0 6 17 1 0 0 0 0 7 12 2 0 0 0 0 7 18 1 0 0 0 0 9 13 2 0 0 0 0 9 19 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 10 14 1 0 0 0 0 11 20 1 0 0 0 0 12 21 1 0 0 0 0 13 23 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 M END $$$$