D0C2OR Wcorina 11010620303D 1 1.00000 0.00000 0 CORINA evaluation license 3.40 0067 02.08.2006 73 74 0 1 0 999 V2000 -0.0169 1.3973 0.0097 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0021 -0.0041 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1881 2.1027 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3073 2.1156 -0.0229 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2146 -0.6751 -0.0576 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1556 -0.7011 0.0924 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3844 1.4191 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3508 3.4271 0.3526 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2990 1.5214 -0.4051 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3984 0.0343 -0.0807 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7357 -1.2104 -1.1073 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6609 2.1688 -0.0517 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.6506 4.1216 0.1600 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.9831 -2.0247 -0.7541 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6524 3.3863 -0.0192 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7197 1.5681 -0.0915 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.7724 3.1710 0.4653 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7388 4.6387 -1.2772 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2202 -1.3716 -1.3730 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.8712 3.0932 -0.3328 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7082 2.4667 1.4597 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6684 5.7089 -1.5007 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7384 -0.3521 -0.4249 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2757 -2.4224 -1.6121 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7277 1.8989 -0.1366 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.7552 6.2183 -2.9164 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2019 0.7935 -1.0185 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1974 -3.2222 -2.6941 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1947 -2.5476 -0.8307 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1653 2.2330 -0.5409 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9076 7.1686 -3.3409 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5878 5.7712 -3.6693 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1894 0.9256 -2.2244 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2225 -4.2427 -2.9264 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7274 3.2955 0.4057 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9047 -4.9948 -4.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1647 3.6296 0.0014 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7125 -5.9835 -4.6072 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9227 -4.7077 -4.8358 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7268 4.6921 0.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1069 5.0129 0.5599 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1865 3.1826 0.0291 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2322 -1.7544 -0.0872 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5753 3.8877 0.7289 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3395 -0.4924 -0.1304 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0125 -0.3846 -1.7613 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0168 -1.8521 -1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7026 4.9737 0.8479 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8753 -3.0385 -1.1395 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0956 -2.0592 0.3302 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5778 3.8134 -1.9708 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7251 5.0701 -1.4483 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9526 -0.9010 -2.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1187 3.7717 -0.9808 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8293 6.5341 -0.8071 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6821 5.2775 -1.3297 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7499 -0.4868 0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7009 1.5872 0.9041 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4623 -3.1221 -3.3191 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1763 2.6138 -1.5622 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7777 1.3333 -0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0019 7.4635 -4.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2407 -4.9371 -2.0864 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1968 -3.7637 -3.0229 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7164 2.9147 1.4269 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1149 4.1952 0.3468 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1757 4.0104 -1.0198 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7772 2.7299 0.0603 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4676 -6.4370 -5.4254 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7158 4.3113 1.9693 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1144 5.5918 0.8891 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5008 5.7129 1.1705 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1522 5.3071 -0.4042 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 2 5 1 0 0 0 0 2 6 1 0 0 0 0 3 7 2 0 0 0 0 3 42 1 0 0 0 0 4 8 1 0 0 0 0 4 9 2 0 0 0 0 5 10 2 0 0 0 0 5 43 1 0 0 0 0 6 11 1 0 0 0 0 7 12 1 0 0 0 0 7 10 1 0 0 0 0 8 13 1 0 0 0 0 8 44 1 0 0 0 0 10 45 1 0 0 0 0 11 14 1 0 0 0 0 11 46 1 0 0 0 0 11 47 1 0 0 0 0 12 15 2 0 0 0 0 12 16 1 0 0 0 0 13 17 1 0 0 0 0 13 18 1 0 0 0 0 13 48 1 0 0 0 0 14 19 1 0 0 0 0 14 49 1 0 0 0 0 14 50 1 0 0 0 0 17 20 1 0 0 0 0 17 21 2 0 0 0 0 18 22 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 19 23 1 0 0 0 0 19 24 1 0 0 0 0 19 53 1 0 0 0 0 20 25 1 0 0 0 0 20 54 1 0 0 0 0 22 26 1 0 0 0 0 22 55 1 0 0 0 0 22 56 1 0 0 0 0 23 27 1 0 0 0 0 23 57 1 0 0 0 0 24 28 1 0 0 0 0 24 29 2 0 0 0 0 25 30 1 0 0 0 0 25 27 1 0 0 0 0 25 58 1 0 0 0 0 26 31 1 0 0 0 0 26 32 2 0 0 0 0 27 33 2 0 0 0 0 28 34 1 0 0 0 0 28 59 1 0 0 0 0 30 35 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 31 62 1 0 0 0 0 34 36 1 0 0 0 0 34 63 1 0 0 0 0 34 64 1 0 0 0 0 35 37 1 0 0 0 0 35 65 1 0 0 0 0 35 66 1 0 0 0 0 36 38 1 0 0 0 0 36 39 2 0 0 0 0 37 40 1 0 0 0 0 37 67 1 0 0 0 0 37 68 1 0 0 0 0 38 69 1 0 0 0 0 40 41 1 0 0 0 0 40 70 1 0 0 0 0 40 71 1 0 0 0 0 41 72 1 0 0 0 0 41 73 1 0 0 0 0 M CHG 2 12 1 16 -1 M END $$$$