BT4O1F -OEChem-04022102093D 43 46 0 0 0 0 0 0 0999 V2000 -0.7045 0.0104 0.4268 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1161 -0.0338 0.5395 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9094 0.0380 -0.0719 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9572 0.0072 -0.2462 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7514 -1.2389 0.1375 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7254 1.2711 0.1285 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1737 -1.1845 -0.4226 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1483 1.2419 -0.4321 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3815 0.0115 -0.4967 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2084 1.2482 -0.2849 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1669 -1.2525 -0.2852 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3289 0.0478 1.3277 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5079 1.1580 0.2235 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4685 -1.2049 0.2239 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6815 2.5133 -0.5831 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6018 -2.4996 -0.5887 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2661 2.3125 0.4391 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1894 -2.3832 0.4385 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4401 3.6653 -0.3719 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3233 -3.6755 -0.3788 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7315 3.5647 0.1405 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6159 -3.6171 0.1366 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8517 0.0009 -1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2629 -2.1438 -0.2291 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7711 -1.3445 1.2296 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7434 1.3868 1.2196 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2164 2.1615 -0.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1266 -1.2548 -1.5173 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7340 -2.0699 -0.0978 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6901 2.1415 -0.1148 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0993 1.3024 -1.5272 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0759 0.0180 -1.5522 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9598 -0.8220 1.5428 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9411 0.9324 1.5361 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4912 0.0416 2.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3063 2.6137 -1.0178 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3842 -2.5682 -1.0326 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2753 2.2422 0.8363 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2001 -2.3455 0.8364 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0262 4.6397 -0.6144 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8799 -4.6356 -0.6264 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3226 4.4609 0.3044 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1782 -4.5319 0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 9 1 0 0 0 0 2 13 1 0 0 0 0 2 14 1 0 0 0 0 3 7 1 0 0 0 0 3 8 1 0 0 0 0 3 12 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 23 1 0 0 0 0 5 7 1 0 0 0 0 5 24 1 0 0 0 0 5 25 1 0 0 0 0 6 8 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 32 1 0 0 0 0 10 13 1 0 0 0 0 10 15 2 0 0 0 0 11 14 1 0 0 0 0 11 16 2 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 12 35 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 15 36 1 0 0 0 0 16 20 1 0 0 0 0 16 37 1 0 0 0 0 17 21 1 0 0 0 0 17 38 1 0 0 0 0 18 22 1 0 0 0 0 18 39 1 0 0 0 0 19 21 2 0 0 0 0 19 40 1 0 0 0 0 20 22 2 0 0 0 0 20 41 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 M END $$$$