MMs00862174 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 56 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 1.4675 0.3105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0789 1.6803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5705 1.5221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6862 2.5248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1123 2.0599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4228 0.5924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3072 -0.4102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8810 0.0546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5813 -0.6942 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4548 -1.8875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2280 3.0626 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6541 2.5978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3301 2.9800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1699 2.9814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9187 4.2811 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4187 4.2825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1699 2.9841 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1675 5.5822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6675 5.5836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4163 6.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6651 8.1817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1651 8.1803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4163 6.8806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9163 6.8792 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -5.4139 9.4814 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -6.9163 6.8847 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.9150 8.3847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9177 5.3847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4163 6.8861 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.1675 5.5877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1651 8.1858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2484 1.1740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 -0.2484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2484 -1.1740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4377 3.6988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5638 0.2206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5556 -1.5842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2822 1.4568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7950 2.2259 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0260 3.7387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4581 3.3894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1228 4.1620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0374 1.7994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2979 2.5720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3178 5.3198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2685 4.5449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5642 9.2190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2062 6.1887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7685 4.5491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1289 4.9868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1254 8.7849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7642 9.2256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2049 7.5868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 14 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 2 0 0 0 0 7 37 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 10 11 1 0 0 0 0 12 13 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 27 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 27 28 2 0 0 0 0 27 29 2 0 0 0 0 27 30 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 31 49 1 0 0 0 0 31 50 1 0 0 0 0 31 51 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 M END