MMs00728933 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 1.2972 0.7531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8953 0.7593 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4934 0.7655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7978 -1.4813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5006 -2.2344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1997 -1.4876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0986 -2.2282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3959 -1.4751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7676 -2.0819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0830 -3.5484 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7687 -0.9648 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0156 0.3324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6224 1.7042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5491 0.0170 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.2608 -1.1181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1396 0.0976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5262 1.4664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4050 2.6821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8971 2.5288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5105 1.1600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6317 -0.0556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0407 0.5975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0029 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2944 1.9531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8289 -0.9149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3716 -0.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4905 1.9655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8320 0.6211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5034 -3.4344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1619 -2.0900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1015 -3.4282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9328 -2.2724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3406 -1.6415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3325 1.5890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9143 3.7772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6001 3.5014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7042 1.0374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1224 -1.1507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 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 35 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 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 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 M END