MMs00039785 MOE2007 2D CORINA 3.40 0006 02.08.2006 64 68 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 1.5000 -0.0015 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2513 1.2968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5026 2.5966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2539 3.8949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7539 3.8934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5026 2.5936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7513 1.2953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7487 -1.3027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4974 -2.6025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9974 -2.6040 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7487 -1.3057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0059 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2487 -1.3072 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9974 -2.6070 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.5974 -1.5677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3860 -3.9767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4997 -4.9815 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7995 -4.2328 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.7995 -5.4328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4891 -2.7652 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.7996 -1.6061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7888 -2.0165 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9026 -3.0213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2911 -4.3910 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.4911 -4.3910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0398 -5.6908 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.5398 -5.6923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2885 -6.9921 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2911 -4.3940 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.7911 -4.3955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5398 -5.6953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0398 -5.6967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7911 -4.3985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0424 -3.0987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5424 -3.0972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0012 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0012 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3026 2.5978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6549 4.9347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3549 4.9320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7026 2.5924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5487 -1.3016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8964 -3.6412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8497 -0.2686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3473 -3.3757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6797 -4.9468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6089 -2.0512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9412 -3.6224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4388 -6.7295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6921 -3.3542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1911 -3.3563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4118 -6.1046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7470 -6.8772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8303 -6.8783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.1670 -6.1083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.7096 -5.1707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.7111 -3.6280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.1704 -2.6894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8352 -1.9167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4152 -2.6857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7519 -1.9156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 6 7 2 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 46 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 22 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 26 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 32 33 1 0 0 0 0 32 37 1 0 0 0 0 32 54 1 0 0 0 0 33 34 1 0 0 0 0 33 55 1 0 0 0 0 33 56 1 0 0 0 0 34 35 1 0 0 0 0 34 57 1 0 0 0 0 34 58 1 0 0 0 0 35 36 1 0 0 0 0 35 59 1 0 0 0 0 35 60 1 0 0 0 0 36 37 1 0 0 0 0 36 61 1 0 0 0 0 36 62 1 0 0 0 0 37 63 1 0 0 0 0 37 64 1 0 0 0 0 M END