MMs01236335 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 57 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 0.7506 -1.2987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0012 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7519 -3.8968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0025 -5.1962 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2519 -3.8960 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0012 -2.5966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2506 -1.2980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2506 -1.2965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5012 -2.5959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7506 -1.2958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 0.0036 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.1000 1.0428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7494 1.3023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 0.0043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7506 -1.2944 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7494 1.3037 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2494 1.3044 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.6494 2.3436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0000 0.0057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5000 0.0064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3811 1.2204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8079 0.7575 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.7784 1.4633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8086 -0.7425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3823 -1.2067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0711 -2.6740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1863 -3.6772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6126 -3.2130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9238 -1.7456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9988 2.6038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2481 3.9025 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0389 0.6005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6005 1.0389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0389 -0.6005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1988 -2.5986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3995 1.0404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0995 1.0417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1017 -3.6349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7883 1.9028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1489 2.3412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7104 0.7018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1489 2.3426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8726 -0.4052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2089 -1.1759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0097 2.3615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9300 -3.0454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9373 -4.8511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5048 -4.0155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0649 -1.3743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4988 2.6045 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0983 3.6440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 11 2 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 45 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 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 30 31 2 0 0 0 0 30 50 1 0 0 0 0 31 32 1 0 0 0 0 31 51 1 0 0 0 0 32 52 1 0 0 0 0 33 34 2 0 0 0 0 33 53 1 0 0 0 0 53 54 1 0 0 0 0 M END