MMs02445921 MOE2007 2D CORINA 3.40 0006 02.08.2006 67 68 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 1.3053 -0.7390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 -2.2390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5853 1.5219 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5853 2.7219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 2.2609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0126 1.4999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2674 3.7608 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0379 4.4998 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0013 5.0998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3306 3.7389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6359 4.4779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6486 5.9779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9539 6.7169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2466 5.9560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2339 4.4560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9286 3.7170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0506 5.9998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3559 6.7388 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2421 6.7607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2294 8.2607 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.8780 2.2828 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1833 1.5438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4760 2.3047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7813 1.5657 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0740 2.3266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0613 3.8265 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3793 1.5876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6720 2.3485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9773 1.6095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9899 0.1095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2952 -0.6295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5879 0.1315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5753 1.6314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2699 2.3704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5912 1.0443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0443 0.5912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5912 -1.0443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2661 -1.3390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -2.2491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3281 -3.4389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5179 -2.2288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0179 -1.1022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7780 0.2402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3015 4.3696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5515 2.8262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0942 2.8132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1315 6.2822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9640 7.9169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2908 6.5472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2680 3.8473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9185 2.5170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 5.6366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4220 6.9790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8679 3.4827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6969 3.2174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2396 3.2304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7914 0.3657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8929 3.2612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4355 3.2742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9558 -0.4992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3054 -1.8294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6322 -0.4598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6094 2.2401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2598 3.5704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 41 1 0 0 0 0 3 42 1 0 0 0 0 3 43 1 0 0 0 0 3 44 1 0 0 0 0 4 5 1 0 0 0 0 4 45 1 0 0 0 0 4 46 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 23 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 47 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 19 1 0 0 0 0 12 13 1 0 0 0 0 12 48 1 0 0 0 0 12 49 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 50 1 0 0 0 0 15 16 1 0 0 0 0 15 51 1 0 0 0 0 16 17 2 0 0 0 0 16 52 1 0 0 0 0 17 18 1 0 0 0 0 17 53 1 0 0 0 0 18 54 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 55 1 0 0 0 0 21 56 1 0 0 0 0 23 24 1 0 0 0 0 23 57 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 27 28 1 0 0 0 0 27 60 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 61 1 0 0 0 0 31 62 1 0 0 0 0 32 33 1 0 0 0 0 32 37 2 0 0 0 0 33 34 2 0 0 0 0 33 63 1 0 0 0 0 34 35 1 0 0 0 0 34 64 1 0 0 0 0 35 36 2 0 0 0 0 35 65 1 0 0 0 0 36 37 1 0 0 0 0 36 66 1 0 0 0 0 37 67 1 0 0 0 0 M END