MMs01157895 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 55 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 1.3020 -0.7448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3081 -2.2448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6101 -2.9895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9061 -2.2343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9001 -0.7343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2082 -2.9791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5042 -2.2238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4982 -0.7238 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4565 -0.1280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7881 1.5314 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0962 -0.7134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1023 -2.2134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8062 -2.9686 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4043 -2.9581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7003 -2.2029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6943 -0.7029 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 0.0418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 0.0523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9842 1.5523 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2923 -0.6925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5883 0.0628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8904 -0.6820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1864 0.0732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4884 -0.6715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4945 -2.1715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1985 -2.9267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8964 -2.1820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5958 1.0416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0416 0.5958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5958 -1.0416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2713 -2.8489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6150 -4.1895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9369 -0.1301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5932 1.2105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4406 -3.9014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9832 -3.8952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6367 -3.8805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1793 -3.8743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1153 -3.3289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8812 -1.9898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6172 0.9580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1599 0.9642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2972 -1.8924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5835 1.2628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1816 1.2732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.5252 -0.0674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.5361 -2.7673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2033 -4.1267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8596 -2.7862 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 16 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 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 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 52 1 0 0 0 0 M END