MMs01948357 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 43 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 1.2979 -0.7519 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6003 1.4962 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8960 -0.7557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4941 -0.7595 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0114 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7942 -1.2114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7964 1.4886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0965 2.2367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0987 3.7367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3989 4.4849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6968 3.7330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6946 2.2330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3945 1.4849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9969 4.4811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0922 -0.7633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0900 -2.2632 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8938 -2.2557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1918 -3.0076 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5937 -3.0038 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2958 -2.2519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0044 -3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5915 -4.5038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6015 1.0384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0384 0.6015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6015 -1.0384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1979 1.1924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4923 -1.9595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6143 1.2820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3876 2.6169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0604 4.3383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4006 5.6849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7330 1.6314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3936 0.8849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9987 5.6811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3915 -4.5020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5898 -5.7038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7915 -4.5055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 -0.0151 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4306 -0.6167 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 23 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 18 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 2 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 41 42 1 0 0 0 0 M END