MMs00894251 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 0.7491 -1.2996 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2491 -1.3007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2491 -1.3029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4981 -2.6013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9981 -2.6003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2472 -3.8987 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9962 -5.1983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7491 -1.3039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 -0.0055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -0.0065 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7509 1.2919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0019 2.5915 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2509 1.2909 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.6509 0.2516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0019 2.5893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2528 3.8889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0038 5.1874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2547 6.4870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7547 6.4881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0038 5.1896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7528 3.8900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0000 -0.0087 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.5000 -0.0098 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.4989 -1.5098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5011 1.4902 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0000 -0.0109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7509 1.2876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2509 1.2865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0000 -0.0131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2491 -1.3116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7491 -1.3105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5000 -0.0142 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0397 0.5992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5992 1.0397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0397 -0.5992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4008 1.0375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1008 1.0355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0974 -3.6410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9566 -5.7976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5955 -6.2380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0359 -4.5991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5398 -2.4856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8764 -1.7152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3727 0.4058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7092 1.1762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5992 -1.0462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9206 1.8173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9217 3.3600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2038 5.1865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8555 7.5258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1555 7.5278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8038 5.1905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4525 3.3706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3992 -1.0475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1517 2.3272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8517 2.3253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8483 -2.3513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1483 -2.3493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 42 1 0 0 0 0 10 43 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 49 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 18 1 0 0 0 0 16 25 1 0 0 0 0 18 19 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 52 1 0 0 0 0 21 22 1 0 0 0 0 21 53 1 0 0 0 0 22 23 2 0 0 0 0 22 54 1 0 0 0 0 23 24 1 0 0 0 0 23 55 1 0 0 0 0 24 56 1 0 0 0 0 25 26 1 0 0 0 0 25 57 1 0 0 0 0 26 27 2 0 0 0 0 26 28 2 0 0 0 0 26 29 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 58 1 0 0 0 0 31 32 1 0 0 0 0 31 59 1 0 0 0 0 32 33 2 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 33 60 1 0 0 0 0 34 61 1 0 0 0 0 M END