MMs01038554 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 55 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 1.3012 -0.7463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3055 -2.2463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8992 -0.7389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1919 1.5148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8907 2.2611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5938 1.5074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4887 2.2685 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7899 1.5222 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7899 2.7222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0868 2.2759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0825 3.7759 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3880 1.5296 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 0.0297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6934 -0.7166 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.7327 -1.3166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 0.0371 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9860 1.5371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6849 2.2833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6806 3.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9775 4.5370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2787 3.7908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2829 2.2908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6977 -2.2166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4008 -2.9703 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9989 -2.9629 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0032 -4.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 1.0409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0409 0.5970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 -1.0409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2619 -1.3463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1055 -2.2497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3089 -3.4463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5054 -2.2429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9027 -1.9389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2371 -0.5822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8873 3.4611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5528 2.1044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5942 0.0188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7976 -1.1778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3942 0.0239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8011 0.1322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9851 -1.0991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6397 4.3804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9741 5.7370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3162 4.3937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3239 1.6937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8032 -4.4663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0066 -5.6629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2032 -4.4595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 27 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 M END