L87MBX -OEChem-05022322153D 33 35 0 0 0 0 0 0 0999 V2000 -1.6407 3.2350 0.1071 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3729 -0.7723 -0.0655 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1285 -2.6739 -0.1111 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7393 2.0489 0.0550 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1953 0.6899 0.0284 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8743 1.1581 0.0201 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5629 0.8756 0.0433 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4717 -0.2364 0.0169 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6079 1.8654 0.0589 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6513 -0.2019 -0.0187 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1429 1.6980 0.0281 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9954 2.1835 0.0843 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0429 -0.5430 -0.0438 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7270 -0.0971 -0.5752 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0989 -1.4555 0.5829 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7485 -1.0627 -0.0509 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2402 0.8373 -0.0044 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6096 -1.1771 -0.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9815 -2.5353 0.5569 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2368 -2.3961 -0.0351 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1869 -1.4405 -0.0763 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0473 3.0197 0.0812 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6701 -0.6568 -0.0256 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3056 2.7713 0.0591 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9984 2.5860 0.1154 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0470 0.8306 -1.0424 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1278 -1.5872 1.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5743 -2.1352 -0.0812 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2303 1.2844 0.0028 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5856 -1.0704 -1.0655 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6918 -3.4844 0.9983 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9236 -3.2372 -0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1378 -1.3862 -0.0881 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 12 1 0 0 0 0 2 21 1 0 0 0 0 2 33 1 0 0 0 0 3 21 2 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 4 22 1 0 0 0 0 5 7 1 0 0 0 0 5 9 2 0 0 0 0 6 10 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 14 2 0 0 0 0 8 15 1 0 0 0 0 10 16 1 0 0 0 0 10 23 1 0 0 0 0 11 17 2 0 0 0 0 11 24 1 0 0 0 0 12 25 1 0 0 0 0 13 16 2 0 0 0 0 13 17 1 0 0 0 0 13 21 1 0 0 0 0 14 18 1 0 0 0 0 14 26 1 0 0 0 0 15 19 2 0 0 0 0 15 27 1 0 0 0 0 16 28 1 0 0 0 0 17 29 1 0 0 0 0 18 20 2 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 20 32 1 0 0 0 0 M END $$$$