MMs01794844 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 0.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3031 -0.7429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3113 -2.2429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0142 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5980 -1.1858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5898 1.5142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8848 2.2713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9012 -0.7287 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9077 -1.9287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1879 1.5284 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4992 -0.7145 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4600 -1.3145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0426 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.9456 0.8911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0972 -0.7003 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.2563 -1.0109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1054 -2.2003 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3054 -2.2003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8105 -2.9574 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.9620 -3.8059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5074 -2.2145 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1304 -4.4229 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6230 -4.5715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2256 -3.1979 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9632 -5.2452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6574 -6.0711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2064 0.3094 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5889 1.6764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0980 1.5115 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5022 3.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8704 2.4560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5943 1.0425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0425 0.5943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5943 -1.0425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2639 -1.3429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1113 -2.2494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3179 -3.4429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5113 -2.2363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4243 -6.3174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0354 -5.7841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5021 -4.1730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4577 -6.0986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6849 -7.2708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8570 -6.0436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7002 3.2432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4328 4.3719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3042 3.1046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4940 1.4308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8956 3.0796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2467 3.4812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2867 2.2571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2802 3.4570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 52 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 22 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 30 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 28 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 25 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 31 46 1 0 0 0 0 31 47 1 0 0 0 0 31 48 1 0 0 0 0 32 49 1 0 0 0 0 32 50 1 0 0 0 0 32 51 1 0 0 0 0 52 53 1 0 0 0 0 M END