MMs01949171 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 41 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 1.5000 0.0056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2451 1.3075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4902 2.6037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0098 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7549 1.2962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4787 4.0229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7315 4.9091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9484 4.0320 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0882 4.4071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9070 4.4810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2244 5.9471 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5350 7.1062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1134 6.9550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3149 6.4968 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6527 6.4052 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7636 5.3973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1919 5.8555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5093 7.3215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3984 8.3294 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9376 7.7797 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0486 6.7718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4769 7.2300 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7312 5.3058 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3029 4.8476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9855 3.3816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5961 -1.0415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1039 -1.0313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4451 1.3120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9549 1.2917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 6.1091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0695 3.2921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1061 4.4346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9066 7.5781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5097 4.2245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1916 8.9525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6199 4.4995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4308 8.4210 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5421 9.2273 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 25 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 36 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 37 1 0 0 0 0 25 26 2 0 0 0 0 38 39 1 0 0 0 0 M END