MMs00484962 MOE2007 2D CORINA 3.40 0006 02.08.2006 62 62 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 1.3032 0.7427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3116 2.2427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5897 -1.5145 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5897 -2.7145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8845 -2.2717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8761 -3.7717 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1877 -1.5290 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4825 -2.2862 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4825 -1.0862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4741 -3.7862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7690 -4.5435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0722 -3.8007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7606 -6.0434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7857 -1.5435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0435 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0806 -2.3008 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3838 -1.5580 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3838 -2.7580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 -0.0581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6954 0.6847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9902 -0.0726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2934 0.6702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3018 2.1701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0069 2.9274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7037 2.1847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6786 -2.3153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9818 -1.5725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6702 -3.8153 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5942 1.0426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0426 -0.5942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5942 -1.0426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 1.3427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5116 2.2360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3183 3.4427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1116 2.2494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0148 1.1108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7786 -0.2295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1944 -0.3290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2936 -3.5712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0574 -4.9115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8082 -5.1435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6664 -4.8433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1147 -3.2066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4780 -2.7582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5606 -6.0367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7539 -7.2434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9606 -6.0501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0772 -2.9008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2092 -0.2598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9880 1.0719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9868 -0.6726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3292 0.0644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3443 2.7643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0136 4.1274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6679 2.7905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6276 -4.4094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7061 -4.4210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2506 -1.6514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2864 -2.2572 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2797 -3.4572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 61 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 40 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 43 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 28 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 25 26 2 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 27 57 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 58 1 0 0 0 0 30 59 1 0 0 0 0 60 61 1 0 0 0 0 61 62 1 0 0 0 0 M END