MMs01788686 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 46 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 1.3031 -0.7430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3112 -2.2430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6142 -2.9859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6223 -4.4859 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9092 -2.2289 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9011 -0.7290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5899 1.5140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8849 2.2710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1880 1.5280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4991 -0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7860 1.5420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4830 2.2850 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0972 -0.7009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 0.0560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6952 -0.6869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9902 0.0701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9821 1.5700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6790 2.3130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3841 1.5560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0810 2.2990 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 11.7033 -2.1869 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.0162 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5944 1.0425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0425 0.5944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5944 -1.0425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5475 2.1084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8785 3.4710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7328 -1.6384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2754 -1.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1904 2.6718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9689 1.3400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8735 -1.6160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3308 -1.6243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0326 -0.5243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0181 2.1756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6726 3.5130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5894 -1.9640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0198 -3.6056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6218 -4.0359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0420 0.0000 N 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 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 14 43 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 24 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 M END