MMs01959021 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 53 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 1.2972 0.7532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0064 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5588 -0.5936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6018 -1.4936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8952 0.7597 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8952 -0.4403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8915 2.2597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5906 3.0064 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0129 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4933 0.7661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4896 2.2661 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0193 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7942 1.2193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7979 -1.4807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0988 -2.2275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3960 -1.4742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 0.0258 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0914 0.7725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6894 0.7790 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.4427 -0.5182 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9362 2.0762 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9866 1.5322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2875 0.7854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5847 1.5386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5810 3.0386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2801 3.7854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9829 3.0322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6026 1.0377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0377 -0.6026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6026 -1.0377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5236 1.6706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0662 1.6744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4018 -1.4965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6048 -2.6936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8018 -1.4906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1991 -1.1871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6156 -1.2752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3903 -2.6093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3298 -3.1486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8724 -3.1448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8092 -2.6008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5772 -1.2629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3178 1.6899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8604 1.6937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2905 -0.4146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6254 0.9412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6187 3.6412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2771 4.9854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9422 3.6296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1887 3.0129 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1857 4.2129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 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 34 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 2 0 0 0 0 8 51 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 51 52 1 0 0 0 0 M END