MMs01725453 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 59 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 -1.2984 -0.7512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 -0.0023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5994 1.4977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3011 2.2488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0013 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 2.2512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5967 1.5023 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2957 3.7512 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5940 4.5023 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5548 5.1023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8938 3.7535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1921 4.5047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4918 3.7558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7902 4.5070 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5927 6.0023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 6.7512 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8964 -0.7535 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1962 -0.0047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4945 -0.7558 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4553 -1.3558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4932 -2.2558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7915 -3.0070 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0912 -2.2581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0926 -0.7581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3923 -0.0093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3936 1.4907 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6907 -0.7605 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.6893 -2.2605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3896 -3.0093 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.3885 -4.2093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9877 -3.0116 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7942 -0.0070 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7956 1.4930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4972 2.2442 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0398 -0.5991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2973 -1.9512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6392 2.0967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3021 3.4488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2559 4.3502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1232 2.8335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6659 2.8349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4199 5.4232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9626 5.4246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8954 -1.9535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4256 0.9153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9683 0.9139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3116 -2.0464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0817 -3.3831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7905 -4.2070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0275 -2.4126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9866 -4.2116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8353 2.0921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4932 2.2558 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8911 6.7535 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8900 7.9535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5329 1.6568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 36 1 0 0 0 0 2 3 2 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 4 5 2 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 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 54 1 0 0 0 0 16 17 2 0 0 0 0 16 55 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 33 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 2 0 0 0 0 24 30 1 0 0 0 0 25 26 1 0 0 0 0 25 33 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 32 51 1 0 0 0 0 32 52 1 0 0 0 0 33 34 1 0 0 0 0 34 35 2 0 0 0 0 34 53 1 0 0 0 0 54 57 1 0 0 0 0 55 56 1 0 0 0 0 M END