MMs00451303 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 58 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 1.2962 -0.7549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2906 -2.2549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8943 -0.7646 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8943 0.4354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2017 1.4805 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4923 -0.7744 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0904 -0.7841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0848 -2.2841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7829 -3.0293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4867 -2.2744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3810 -3.0390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3753 -4.5390 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6828 -2.2939 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9790 -3.0488 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.9790 -1.8488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9734 -4.5488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2696 -5.3036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5714 -4.5585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2640 -6.8036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2809 -2.3036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5771 -3.0585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6039 1.0370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 0.6039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6039 -1.0370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 -1.3549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0906 -2.2504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2861 -3.4549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4906 -2.2594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8302 0.9124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3728 0.9066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0263 0.8929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5690 0.8871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5050 0.3419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2714 -0.9970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0848 -3.4841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5508 -3.9514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0081 -3.9456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3057 -2.0616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0720 -3.4005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6873 -1.0939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7924 -4.3359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5587 -5.6748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3088 -5.9036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1675 -5.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6129 -3.9624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9754 -3.5170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0640 -6.7991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2595 -8.0036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4640 -6.8081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8472 -2.8607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2865 -0.8037 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8886 -2.2646 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9256 -2.8685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3280 -0.2076 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 56 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 24 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 47 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 24 25 2 0 0 0 0 24 55 1 0 0 0 0 54 56 1 0 0 0 0 55 58 1 0 0 0 0 56 57 1 0 0 0 0 M END