MMs00468274 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 59 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 1.2976 0.7525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2947 2.2525 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3339 1.6525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0795 3.1318 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5205 2.0926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5402 4.5593 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6189 4.2487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6750 5.4386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6779 6.9386 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8868 4.5546 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4205 3.1289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2999 1.9137 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3143 5.0154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4271 4.0096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8545 4.4703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9673 3.4645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3948 3.9253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7095 5.3919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5967 6.3977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1692 5.9370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0402 4.5622 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5392 4.6174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5833 3.5404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0380 3.9061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4487 5.3488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4046 6.4258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9499 6.0601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7047 6.8965 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5245 5.9708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0818 6.3814 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6020 1.0381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0381 -0.6020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -1.0381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2976 -0.4475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0001 -1.0354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6385 -0.5930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1961 1.0454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7529 6.0760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2613 5.7524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4800 3.2726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9884 2.9489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7156 2.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2850 3.1206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8515 5.7605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8485 7.5710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2790 6.7416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2548 2.3863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8733 3.0445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6125 5.6414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7332 7.5800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6605 8.0957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5065 3.1365 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6485 2.7679 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 1 0 0 0 0 2 4 1 0 0 0 0 2 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 54 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 13 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 31 1 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 53 1 0 0 0 0 31 32 2 0 0 0 0 54 55 1 0 0 0 0 M END