MMs00700984 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 40 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 1.2937 -0.7592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8917 -0.7778 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4897 -0.7963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -0.0555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8047 1.4444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5111 2.2037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2067 1.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1091 2.1851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1198 3.6851 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4027 1.4259 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.7071 2.1666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7178 3.6666 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.0007 1.4074 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.3051 2.1481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5988 1.3889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9031 2.1296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9138 3.6296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6201 4.3888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3158 3.6481 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.2181 4.3703 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6074 1.0349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0349 0.6074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6074 -1.0349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5158 -1.6730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0584 -1.6840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8332 0.9062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3759 0.8952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4811 -1.9962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8290 -0.6629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5196 3.4036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1718 2.0703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3942 0.2259 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9922 0.2074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5902 0.1889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9380 1.5222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6287 5.5888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 36 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 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 M END