MMs01546903 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 54 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 1.4803 0.2425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4304 -0.9182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0104 1.6457 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1868 2.8993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1246 4.0700 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5278 3.5399 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4572 2.0415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6279 1.1037 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0254 1.6487 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.0647 2.2487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2523 3.1314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1961 0.7109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9693 -0.7719 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5936 1.2558 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7643 0.3180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1618 0.8629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4241 0.0526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5849 1.0028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0399 2.4003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5424 2.3139 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3115 2.9699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9995 4.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4979 4.3734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3082 3.1111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6202 1.7782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1218 1.7076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8065 3.1817 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4946 4.5146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 1.1842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1842 -0.1940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 -1.1842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1697 -0.9166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5018 -1.6783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1905 -1.8468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3590 -0.1581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4385 2.9500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4337 4.3176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0661 3.3129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7751 2.4420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8628 -0.4740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3878 -0.7073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4933 -1.1454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7456 0.6983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6882 3.4101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3513 5.3127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0483 5.4397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2684 0.7684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5714 0.6413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4282 5.0650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0450 5.5809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5609 3.9642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 2 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 M END