MMs02604777 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 1.3033 -0.7426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3118 -2.2426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6150 -2.9852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9098 -2.2279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2131 -2.9705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5078 -2.2132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4993 -0.7132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9013 -0.7279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6235 -4.4852 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9268 -5.2279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9353 -6.7278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6405 -7.4852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3372 -6.7425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3287 -5.2426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2863 -2.2573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5811 -3.0147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8843 -2.2720 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5941 1.0426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0426 0.5941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2971 -0.5213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2198 -4.1705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5504 -2.8073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5351 -0.1073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1893 1.2294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3308 -4.0979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1097 -5.4295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1158 -6.5128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3521 -7.8531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9332 -7.8725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1543 -6.5409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1203 -4.6799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1482 -5.4576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4053 -3.4574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7491 -3.9236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9032 -1.7955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0628 -1.3424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0147 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5726 -4.5146 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6084 -5.1205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 40 2 0 0 0 0 3 4 2 0 0 0 0 3 17 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 2 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 41 42 1 0 0 0 0 M END