MMs01298219 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 53 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 1.3005 -0.7474 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2613 -1.3474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8986 -0.7423 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9016 -2.2423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6040 -2.9949 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5648 -3.5949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3035 -2.2474 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6070 -4.4949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0103 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9487 -1.2873 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4436 1.3078 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4937 0.7628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4907 2.2628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7883 3.0154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0888 2.2680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0918 0.7680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3864 3.0205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3834 4.5205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6869 2.2731 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9844 3.0257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9815 4.5257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2790 5.2782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5795 4.5308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5825 3.0308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2849 2.2783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8830 2.2834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1356 0.9829 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 17.6304 3.5839 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 18.1835 1.5360 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.5979 1.0404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0404 0.5979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5979 -1.0404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8249 0.9229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3676 0.9259 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0829 -2.0316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3142 -3.3691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4070 -4.4972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6093 -5.6949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8070 -4.4925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4503 2.8608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7859 4.2154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1322 0.1700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7966 -1.1846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6892 1.0731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9410 5.1236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2766 6.4782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6176 5.1329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2873 1.0783 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 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 M END