MMs01166834 MOE2007 2D CORINA 3.40 0006 02.08.2006 60 62 0 0 0 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 1.3022 -0.7445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9003 -0.7335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4983 -0.7225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5047 -2.2225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8069 -2.9670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1027 -2.2115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0964 -0.7115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4049 -2.9560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4113 -4.4559 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7008 -2.2005 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6944 -0.7005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 0.0550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2925 -0.6895 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9839 1.5550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2798 2.3105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4302 3.8029 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.8961 4.1210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6516 2.8252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6527 1.7062 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.0030 -2.9449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0093 -4.4449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3115 -5.1894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6074 -4.4339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6010 -2.9339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2988 -2.1895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5956 1.0418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0418 0.5956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5956 -1.0418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5348 -1.6670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0774 -1.6605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8228 0.9270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3655 0.9335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1328 -1.6560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6755 -1.6495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4209 0.9380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9636 0.9445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4680 -2.8269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8119 -4.1669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1330 -0.1071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7891 1.2330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5135 -0.9139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2792 0.4254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9421 2.1506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3796 5.2193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8456 2.7048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9637 -3.5449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8267 -4.2416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6037 -5.5743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5441 -6.1119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0868 -6.1054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0226 -5.5598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7883 -4.2205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7837 -3.1373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0067 -1.8046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5236 -1.2735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0663 -1.2669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 11 44 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 24 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 24 25 1 0 0 0 0 24 29 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 29 59 1 0 0 0 0 29 60 1 0 0 0 0 M END