MMs03167868 MOE2007 2D CORINA 3.40 0006 02.08.2006 45 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 1.2955 -0.7561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0122 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5588 0.5878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6051 1.4878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8936 -0.7682 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8543 -1.3682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2031 1.4757 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4916 -0.7804 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0365 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7941 -1.2365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8012 1.4635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1037 2.2074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1107 3.7074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4133 4.4513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7088 3.6952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7017 2.1952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3992 1.4513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0113 4.4391 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0169 5.6391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0897 -0.7926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0487 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4286 -0.6535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3950 0.5513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0826 -2.2925 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6049 1.0364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0364 0.6049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6049 -1.0364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5199 -1.6717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0625 -1.6789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8051 1.4822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6107 2.6878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4051 1.4934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4860 -1.9804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6184 1.2607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3960 2.5930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0743 4.3122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4189 5.6513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7382 1.5904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3964 0.8513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8865 -2.2682 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.6866 -2.2626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8809 -3.4682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0865 -2.2738 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 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 42 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 22 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 22 26 2 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 42 45 1 0 0 0 0 M CHG 1 42 1 M END