MMs02533852 MOE2007 2D CORINA 3.40 0006 02.08.2006 69 70 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 1.2955 -0.7561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2885 -2.2561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0122 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6373 0.5878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8936 -0.7683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8865 -2.2683 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0244 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4916 -0.7805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8012 1.4634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1037 2.2073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3992 1.4512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0896 -0.7927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7018 2.1951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9973 1.4390 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6051 1.4878 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3096 2.2439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3166 3.7439 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4757 3.4333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5343 4.6198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0775 6.0486 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5775 6.0556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1073 4.6312 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3215 4.1744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6402 2.7087 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4315 5.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8602 4.7265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4034 3.2978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2890 4.2697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3170 6.1552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6049 1.0364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0364 0.6049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6049 -1.0364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2563 -1.3561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0885 -2.2504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2828 -3.4561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4884 -2.2617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2017 1.1756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7159 -1.6961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2586 -1.7034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -1.2366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6185 1.2606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3961 2.5929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3367 3.1301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8794 3.1229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4385 0.8512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5749 0.1540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7973 -1.1783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3140 -1.7083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8567 -1.7156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6471 2.0829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1294 3.5778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6328 5.1028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7085 7.2484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5951 6.3106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9749 3.1150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0379 2.1548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2604 3.6632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4717 4.8412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4320 3.9042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1062 3.6982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1741 6.5207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6825 7.2982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8885 5.9725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7088 3.6951 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7509 4.2902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 18 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 45 1 0 0 0 0 11 46 1 0 0 0 0 12 13 1 0 0 0 0 12 47 1 0 0 0 0 12 48 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 49 1 0 0 0 0 14 15 1 0 0 0 0 14 50 1 0 0 0 0 14 51 1 0 0 0 0 15 52 1 0 0 0 0 15 53 1 0 0 0 0 16 17 2 0 0 0 0 16 68 1 0 0 0 0 18 19 1 0 0 0 0 18 54 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 23 1 0 0 0 0 21 26 1 0 0 0 0 23 24 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 57 1 0 0 0 0 25 58 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 33 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 31 61 1 0 0 0 0 32 62 1 0 0 0 0 32 63 1 0 0 0 0 32 64 1 0 0 0 0 33 65 1 0 0 0 0 33 66 1 0 0 0 0 33 67 1 0 0 0 0 68 69 1 0 0 0 0 M END