MMs02585992 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 45 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 1.3006 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 -0.0052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8986 0.7421 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9017 2.2421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6041 2.9947 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5649 3.5947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3036 2.2474 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6072 4.4947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1931 -1.5105 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4967 0.7369 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4967 -0.4631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4997 2.2369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0157 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0948 0.7316 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.8421 -0.5689 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3474 2.0322 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3953 1.4790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3983 2.9790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6989 3.7264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9964 2.9738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9934 1.4738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6928 0.7264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2909 0.7211 0.0000 Cl 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 -0.9261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4923 2.1367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3144 3.3689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8072 4.4923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6096 5.6947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4072 4.4972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6997 2.2345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5021 3.4369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8997 2.2381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7918 -1.2157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3603 3.5811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7013 4.9264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0369 3.5717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6904 -0.4736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 4 31 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 32 1 0 0 0 0 6 33 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 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 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 15 1 0 0 0 0 13 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 44 1 0 0 0 0 M END