MMs03641413 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 52 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 1.2942 -0.7582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2847 -2.2582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6075 1.4835 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6075 2.6835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3133 2.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3228 3.7417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9113 2.2252 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2056 1.4670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5093 2.2087 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6608 3.0572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6756 3.6995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1448 4.0020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8865 2.6982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8758 1.5899 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1783 0.1207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0572 -0.8759 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6019 -0.3518 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.7610 -0.6624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9045 -1.8210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3281 -2.2936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7834 -2.8176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6066 1.0354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0354 0.6066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6066 -1.0354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 -1.3582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0847 -2.2506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2771 -3.4582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4847 -2.2658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0013 -1.1467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7811 0.1844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9189 3.4252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4756 3.7071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5578 4.8937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7812 5.1456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2441 4.4831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8618 3.3974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6838 1.8014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2150 -2.9801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9500 -3.4325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4670 -2.6716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7061 -1.1547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9861 -1.9207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8865 -3.6149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5807 -3.7145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8619 0.2667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0095 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7230 0.6448 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4810 1.8201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0259 2.1066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 49 1 0 0 0 0 9 10 1 0 0 0 0 9 34 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 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 50 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 48 50 1 0 0 0 0 49 52 1 0 0 0 0 50 51 1 0 0 0 0 M END