MMs03338854 MOE2007 2D CORINA 3.40 0006 02.08.2006 27 27 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 1.2979 -0.7519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2957 -2.2519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5936 -3.0038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8938 -2.2558 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8960 -0.7558 0.0000 C 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 5.1961 -0.0077 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4941 -0.7596 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.7422 -2.0575 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2460 0.5383 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7920 -1.5115 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0921 -0.7635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7898 -3.0115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6015 1.0383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0383 0.6015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6015 -1.0383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2556 -2.8504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5919 -4.2038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5998 1.1962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1979 1.1923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6906 -1.8036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1323 -0.1650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4937 0.2767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5898 -3.0098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7880 -4.2115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9898 -3.0133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 22 1 0 0 0 0 13 23 1 0 0 0 0 13 24 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 14 27 1 0 0 0 0 M END