MMs01921413 MOE2007 2D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 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 1.2974 -0.7529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 -2.2529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5914 -3.0058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8921 -2.2587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8954 -0.7587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0116 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.1894 -3.0116 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4902 -2.2645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4935 -0.7645 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7875 -3.0174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0882 -2.2703 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.3856 -3.0232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6863 -2.2761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0014 -0.8096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4936 -0.6561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1006 -2.0278 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.9837 -3.0290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9803 -4.5290 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6796 -5.2761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3822 -4.5232 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.1067 0.7128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2278 1.9283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7356 1.7749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1225 0.4059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5880 -4.5058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6023 1.0379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0379 0.6023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6023 -1.0379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2534 -2.8506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6007 1.1942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1868 -4.2116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0141 -3.9349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5568 -3.9384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6769 -6.4761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1001 0.0396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9422 1.5742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3075 2.4520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8996 3.0826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8220 2.9718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5719 2.0678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2870 -0.4554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1291 1.0792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 -4.5031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5853 -5.7058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7880 -4.5085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 22 2 0 0 0 0 15 16 1 0 0 0 0 15 19 2 0 0 0 0 16 17 2 0 0 0 0 16 26 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 M END