MMs01498643 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 53 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 -2.2498 -1.2994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -0.0005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2502 1.2987 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0502 1.2989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0004 2.5976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2506 3.8968 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5004 2.5974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5043 3.7120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8745 3.1016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7175 1.6099 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.2502 1.2982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -0.0007 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.8783 4.2162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1285 5.5154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6613 5.2037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0004 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5004 -2.5978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2506 -3.8968 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2502 -1.2987 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7502 -1.2985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7502 -1.2980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0004 -2.5972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5004 -2.5974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2502 -1.2978 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 0.0014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0393 -0.5998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5998 1.0393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0393 0.5998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3774 -1.7100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0412 -2.4811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6812 3.3243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8493 4.9214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2249 6.0033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7579 6.6567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4613 5.2039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5360 6.3972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2089 -3.7798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1272 -3.0087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -0.2596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8998 1.0398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5998 1.0402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6005 -3.6363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9005 -3.6367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0393 -0.5985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5998 1.0407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9607 0.6012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7498 -1.2992 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 50 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 50 1 0 0 0 0 3 4 1 0 0 0 0 3 13 2 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 9 10 2 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 50 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 M END