BD4FZ8 -OEChem-04022114053D 36 39 0 0 0 0 0 0 0999 V2000 1.0779 3.4788 0.4526 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7754 4.2290 -0.2678 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.6814 -0.7565 2.3416 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2456 -1.0814 -1.0164 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8055 1.4298 0.5204 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 1.8027 -0.4785 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7755 -0.2561 -0.5046 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0544 -0.7558 -0.2191 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5186 1.1034 -0.2715 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0310 0.1283 0.2907 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5658 1.8599 0.2313 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3640 -2.1092 -0.4339 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5235 -1.4296 -0.5353 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2926 -0.3888 0.5668 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6354 -2.5969 -0.1481 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6013 -1.7347 0.3531 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4803 3.0592 -0.1327 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9753 -0.9148 0.6798 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3369 -2.2887 -1.2744 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2405 -1.2588 1.1559 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6020 -2.6329 -0.7982 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0540 -2.1179 0.4167 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1490 3.2310 -0.9282 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0428 -1.6168 -1.8307 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6314 -2.8133 -0.8203 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0703 0.2635 0.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8700 -3.6437 -0.3147 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5968 -2.1048 0.5799 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3521 -0.2609 1.2829 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9977 -2.6968 -2.2231 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2354 -3.3017 -1.3737 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0405 -2.3895 0.7822 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0265 3.8704 -1.0546 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4004 2.4238 -0.2346 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8797 2.8090 -1.9002 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9941 -0.1791 2.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 17 1 0 0 0 0 2 17 1 0 0 0 0 2 23 1 0 0 0 0 3 20 1 0 0 0 0 3 36 1 0 0 0 0 4 7 1 0 0 0 0 4 13 1 0 0 0 0 4 24 1 0 0 0 0 5 10 1 0 0 0 0 5 11 2 0 0 0 0 6 9 1 0 0 0 0 6 17 2 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 8 10 1 0 0 0 0 8 12 2 0 0 0 0 9 11 1 0 0 0 0 10 14 2 0 0 0 0 12 15 1 0 0 0 0 12 25 1 0 0 0 0 13 18 2 0 0 0 0 13 19 1 0 0 0 0 14 16 1 0 0 0 0 14 26 1 0 0 0 0 15 16 2 0 0 0 0 15 27 1 0 0 0 0 16 28 1 0 0 0 0 18 20 1 0 0 0 0 18 29 1 0 0 0 0 19 21 2 0 0 0 0 19 30 1 0 0 0 0 20 22 2 0 0 0 0 21 22 1 0 0 0 0 21 31 1 0 0 0 0 22 32 1 0 0 0 0 23 33 1 0 0 0 0 23 34 1 0 0 0 0 23 35 1 0 0 0 0 M END $$$$