MMs00398169 MOE2007 2D CORINA 3.40 0006 02.08.2006 61 63 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 1.2971 0.7533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0066 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2933 2.2533 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5904 3.0066 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6296 3.6066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5866 4.5066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2856 5.2533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0115 4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3124 5.2467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3163 6.7467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0192 7.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2818 6.7533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8914 2.2599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8952 0.7600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1885 3.0133 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4894 2.2666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7865 3.0199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0875 2.2732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0913 0.7732 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4933 0.7666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 0.0265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3961 -1.4735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6894 0.7799 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 0.0332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2875 0.7865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5884 0.0398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8855 0.7931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8817 2.2931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5807 3.0398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2836 2.2865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6027 1.0377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0377 -0.6027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6027 -1.0377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2525 2.8507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7689 4.3013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9941 5.6353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0084 3.3000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3501 4.6440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3570 7.3440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0222 8.7000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3195 7.3559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1854 4.2133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4894 3.4666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0129 3.9372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5555 3.9411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4950 3.4019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2698 2.0679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5679 -0.8974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0252 -0.9013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3110 0.9719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0857 -0.3621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6863 1.9799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2213 -0.8880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7640 -0.8841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5915 -1.1602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9263 0.1958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9194 2.8958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5777 4.2398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2429 2.8838 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 14 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 54 1 0 0 0 0 26 27 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 29 58 1 0 0 0 0 30 31 2 0 0 0 0 30 59 1 0 0 0 0 31 32 1 0 0 0 0 31 60 1 0 0 0 0 32 61 1 0 0 0 0 M END