MMs01041870 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 1.3014 -0.7459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3061 -2.2459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0081 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6373 0.6081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8994 -0.7378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9041 -2.2378 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0162 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4975 -0.7297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5022 -2.2297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8036 -2.9756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1003 -2.2216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0956 -0.7216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 0.0325 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6936 -0.7134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5934 1.5081 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 2.2541 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5461 0.9527 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0379 3.5554 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0094 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1708 4.4913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6390 4.7985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3850 3.4972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3778 2.3856 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2984 0.5206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0411 0.5967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5967 -1.0411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2621 -1.3459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1061 -2.2497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3098 -3.4459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5061 -2.2422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1924 1.2162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4648 -2.8329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8073 -4.1756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1414 -2.8183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7904 1.2244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0969 -1.7545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7347 -1.3102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2904 0.3277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6307 2.1114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7184 5.2970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1305 5.8933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5780 3.3680 0.0000 H 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 1 0 0 0 0 2 4 1 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 17 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 2 0 0 0 0 21 25 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 44 1 0 0 0 0 M END