MMs01389586 MOE2007 2D CORINA 3.40 0006 02.08.2006 62 64 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 0.0039 -1.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0353 -0.9000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2932 -2.2534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2893 -3.7534 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5942 -1.5068 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8912 -2.2601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8873 -3.7601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1844 -4.5135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4854 -3.7669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4893 -2.2669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1922 -1.5135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7903 -1.5203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0874 -2.2737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7942 -0.0203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3049 -2.2466 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6020 -1.4932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0068 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 -2.2398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9069 -3.7398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2078 -4.4865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5049 -3.7331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5010 -2.2331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2000 -1.4865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7981 -1.4797 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.0447 -0.1826 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5515 -2.7768 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0952 -0.7263 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0913 0.7737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3962 -1.4729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6933 -0.7196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9942 -1.4662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9981 -2.9662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7011 -3.7196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4001 -2.9729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2991 -3.7128 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5962 -2.9594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0031 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5973 -0.3068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8466 -4.3574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1813 -5.7135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5231 -4.3696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1954 -0.3135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5942 -0.0172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7973 1.1797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9942 -0.0234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8692 -4.3425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2110 -5.6865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5457 -4.3304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1969 -0.2865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2913 0.7768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0882 1.9737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8913 0.7705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6901 0.4804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0319 -0.8635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7042 -4.9195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3624 -3.5756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1989 -3.9971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6339 -2.3567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9935 -1.9217 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 2 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 43 1 0 0 0 0 10 11 2 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 45 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 22 23 2 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 52 1 0 0 0 0 25 26 2 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 56 1 0 0 0 0 32 33 1 0 0 0 0 32 57 1 0 0 0 0 33 34 2 0 0 0 0 33 36 1 0 0 0 0 34 35 1 0 0 0 0 34 58 1 0 0 0 0 35 59 1 0 0 0 0 36 37 1 0 0 0 0 37 60 1 0 0 0 0 37 61 1 0 0 0 0 37 62 1 0 0 0 0 M END