MMs01864797 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 53 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 1.2956 -0.7560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2887 -2.2559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6049 1.4880 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6049 2.6880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3094 2.2440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0069 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9074 2.2321 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9129 3.4321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2030 1.4761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0239 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5055 2.2201 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8010 1.4642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1035 2.2082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8148 4.4641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5124 3.7201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4129 4.4522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7085 3.6962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7016 2.1962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9971 1.4403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9902 -0.0597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6878 -0.8037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3991 1.4522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6048 1.0365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0365 0.6048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6048 -1.0365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2563 -1.3560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0887 -2.2504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2832 -3.4559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4887 -2.2615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0033 -1.1414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7808 0.1910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0255 0.5485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5682 0.5414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5087 1.0787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2862 2.4111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0477 5.3869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5904 5.3798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3296 3.5172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1071 4.8496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4184 5.6522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7504 4.2914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0391 2.0355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0267 -0.6645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6823 -2.0037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3502 -0.6430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8809 1.7546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3163 3.7440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1104 3.7082 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2798 4.3488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 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 50 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 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 37 1 0 0 0 0 15 38 1 0 0 0 0 15 51 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 16 51 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 49 1 0 0 0 0 50 52 1 0 0 0 0 M END