MMs03373118 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 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 1.2958 -0.7556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2893 -2.2556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8938 -0.7668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4919 -0.7781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8006 1.4663 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0899 -0.7893 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3987 1.4550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6880 -0.8006 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.6488 -1.4006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6815 -2.3005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 -0.0562 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2860 -0.8118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2796 -2.3118 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5883 -0.0674 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 15.5883 -1.2674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5948 1.4326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8971 2.1769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1929 1.4213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4951 2.1657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5016 3.6657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2058 4.4213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9036 3.6769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8039 4.4101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6045 1.0366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0366 0.6045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6045 -1.0366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2566 -1.3556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0893 -2.2504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2841 -3.4556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4893 -2.2608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8307 0.9113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3734 0.9047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1185 -1.6828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6612 -1.6894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2592 -1.7007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7166 -1.6940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0847 -1.9893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4815 -2.2954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6763 -3.5005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8815 -2.3057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9955 1.1438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4121 1.2293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1893 2.5620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1877 0.2213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.5317 1.5612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2110 5.6213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8669 4.2814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.8091 5.6100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8789 -2.0230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0225 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2013 1.1775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8841 -0.8230 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.9259 -0.2275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 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 4 36 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 54 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 6 54 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 41 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 56 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 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 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 53 56 1 0 0 0 0 54 55 1 0 0 0 0 56 57 1 0 0 0 0 M END