MMs01050704 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 46 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 -1.3027 -0.7437 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 0.0126 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5588 0.6126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9007 -0.7311 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9399 -1.3311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9080 -2.2311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2106 -2.9748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2179 -4.4748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9225 -5.2311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6198 -4.4874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6126 -2.9874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3099 -2.2437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0145 -3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1961 0.0251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1888 1.5251 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4987 -0.7186 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7941 0.0377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0968 -0.7060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3922 0.0503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3849 1.5502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0823 2.2940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7869 1.5377 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.6803 2.3065 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.5908 1.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3730 2.3883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8296 3.8172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3296 3.8244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8000 2.4001 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 -1.0421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0421 0.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 1.0421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2469 -2.3698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2600 -5.0698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9283 -6.4311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5835 -5.0924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5045 -1.9186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1026 -1.9060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4343 -0.5447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0765 3.4939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2336 2.0120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1196 4.7846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0303 4.7986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 25 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 15 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 25 26 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 41 1 0 0 0 0 27 28 2 0 0 0 0 27 42 1 0 0 0 0 28 29 1 0 0 0 0 28 43 1 0 0 0 0 M END