MMs00271543 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 57 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 1.3024 -0.7441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3093 -2.2441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6117 -2.9882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9073 -2.2323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9005 -0.7323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2097 -2.9764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2166 -4.4763 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5054 -2.2205 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8078 -2.9645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8146 -4.4645 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1170 -5.2086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4127 -4.4527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4058 -2.9527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1034 -2.2086 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.7014 -2.1968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0039 -2.9409 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.0039 -1.7409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0107 -4.4409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7151 -5.1968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7219 -6.6968 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2995 -2.1850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2927 -0.6850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5883 0.0709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8907 -0.6732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8975 -2.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6019 -2.9291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2000 -2.9173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.2068 -4.4173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1863 0.0827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.1795 1.5826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5953 1.0419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0419 0.5953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5953 -1.0419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2728 -2.8488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6171 -4.1881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9370 -0.1276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5926 1.2118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4999 -1.0205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1225 -6.4086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9259 -1.2811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4686 -1.2741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1915 -4.2272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4262 -5.5667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2507 -0.0898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5828 1.2708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6074 -4.1291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0068 -4.4227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2123 -5.6173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.4068 -4.4118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.3795 1.5881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1741 2.7826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9795 1.5772 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 21 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 23 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 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 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 31 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 31 32 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 M END