MMs01047252 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 -0.7538 1.2969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2379 1.5143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3338 0.4900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9749 -1.8459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5433 -1.3982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5132 -1.7603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8150 -1.0152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1112 -1.7701 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.4131 -1.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4187 0.4750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7093 -1.7799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0111 -1.0348 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.0168 0.4652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3187 1.2103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3243 2.7103 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.6149 0.4554 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -15.0432 0.9136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.9203 -0.3033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0340 -1.5135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6092 -1.0446 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -13.9198 -2.2037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3074 -1.7897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3017 -3.2897 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8772 0.8189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9937 -0.6728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3918 1.6544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8479 2.4932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8039 2.6331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2320 2.1865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9374 1.5272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4793 0.1325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3710 -2.8828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8516 -2.6653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 -1.5728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4491 -2.5945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2811 -2.6825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7384 -2.6766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0472 -0.0931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5898 -0.0989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1067 -2.9701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9345 -2.6962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4772 -2.7020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8343 0.2613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6106 1.5944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5592 2.0117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.0847 1.5097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.8151 0.4963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.8090 -1.1096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.0710 -2.1174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5418 -2.6079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2170 -1.0054 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.2170 -2.2054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 4 52 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 5 52 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 7 52 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 41 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 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END