MMs01037246 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 56 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 1.2976 -0.7525 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2584 -1.3525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2948 -2.2525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5924 -3.0049 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5531 -3.6049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8928 -2.2574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0099 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1569 0.5901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1990 1.4901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4995 2.2377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7971 1.4852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4938 -0.7623 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4938 0.4377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4909 -2.2623 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7885 -3.0148 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.0360 -4.3124 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5410 -1.7172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0861 -3.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3866 -3.0197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6842 -3.7722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6813 -5.2722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3809 -6.0197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0833 -5.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9790 -6.0247 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.5895 -4.5049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 1.0381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0381 0.6020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6020 -1.0381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1134 -2.0418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8822 -3.3793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3011 -3.3858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0750 -2.0513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8285 0.9158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3712 0.9128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0168 1.2840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7907 2.6185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7299 3.1584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2725 3.1554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2096 2.6120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9784 1.2746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9764 0.1913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2025 -1.1432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4505 -2.8604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3889 -1.8197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7246 -3.1742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3786 -7.2197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0429 -5.8653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3895 -4.5026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5872 -5.7049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7895 -4.5072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8957 -0.7574 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 28 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 7 54 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 8 54 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 9 54 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 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 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 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 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 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 49 1 0 0 0 0 26 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 M END