MMs01105657 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 1.2954 0.7562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2882 2.2562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0144 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3099 2.2437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3026 0.7437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6125 2.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6197 4.4874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3243 5.2437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0217 4.4999 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3315 6.7437 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9079 2.2312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9007 0.7312 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2105 2.9749 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5059 2.2187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8086 2.9624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1040 2.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0968 0.7062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7941 -0.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4987 0.7187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3922 -0.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3850 -1.5500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6948 0.6937 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.9902 -0.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2929 0.6812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3001 2.1812 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.5883 -0.0751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.8909 0.6687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.1863 -0.0876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.1791 -1.5875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.8765 -2.3313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.5811 -1.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.4745 -2.3438 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0058 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3375 0.1613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3245 2.8612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3390 0.1387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6618 5.0824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0147 5.1049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2163 4.1749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8144 4.1624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1461 2.8012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7884 -1.2375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4566 0.1237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2145 -0.9781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7571 -0.9855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.8967 1.8687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.2284 0.5074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.8707 -3.5313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5389 -2.1700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 10 39 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 40 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 47 1 0 0 0 0 29 30 1 0 0 0 0 29 48 1 0 0 0 0 30 31 2 0 0 0 0 30 33 1 0 0 0 0 31 32 1 0 0 0 0 31 49 1 0 0 0 0 32 50 1 0 0 0 0 M END