B9TR1O -OEChem-04022106162D 33 35 0 0 0 0 0 0 0999 V2000 4.4088 -1.5738 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8509 1.5738 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.4503 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4339 0.4506 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1906 0.0497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4088 0.6732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1906 -0.9503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0846 0.5843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9906 0.0705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0846 -1.4850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9906 -0.9711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4339 -1.3513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8547 0.5738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.4503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7227 0.0772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7265 -0.9228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5868 0.5805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5945 -1.4195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4547 0.0838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4586 -0.9162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8936 1.0597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1398 1.2318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0774 1.2043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0774 -2.1050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0473 0.9354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5264 -1.2832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8294 -1.4893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4339 -1.9713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1908 -1.2349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5844 1.2005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5969 -2.0395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9905 0.3959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9967 -1.2241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 12 1 0 0 0 0 2 13 2 0 0 0 0 3 14 2 0 0 0 0 4 6 1 0 0 0 0 4 14 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 5 8 1 0 0 0 0 6 21 1 0 0 0 0 6 22 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 8 23 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 26 1 0 0 0 0 12 14 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 16 29 1 0 0 0 0 17 19 2 0 0 0 0 17 30 1 0 0 0 0 18 20 2 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 20 33 1 0 0 0 0 M END $$$$