MMs01129864 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 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 1.2981 -0.7515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8962 -0.7546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4943 -0.7577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4925 -2.2577 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0093 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7960 1.4907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0959 2.2392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3941 1.4876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 -0.0124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6904 -0.7639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6887 -2.2639 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9904 -0.0155 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.0289 -0.6167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9922 1.4845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6940 2.2361 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2921 2.2330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5902 1.4814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5884 -0.0186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8866 -0.7701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1865 -0.0217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1883 1.4783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8902 2.2299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4847 -0.7732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0924 -0.7608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6012 1.0385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0385 0.6012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6012 -1.0385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5257 -1.6699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0684 -1.6717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8278 0.9171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3705 0.9152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1238 -1.6730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6665 -1.6748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4259 0.9140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9686 0.9121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6140 1.2837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3869 2.6188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3257 3.1593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8684 3.1575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5218 3.1532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0645 3.1513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5485 -0.6173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8852 -1.9701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2283 2.0771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8916 3.4299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8834 -1.8117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.5232 -1.3744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.0859 0.2653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3199 -1.6792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8626 -1.6810 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 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 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 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 2 0 0 0 0 11 18 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 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 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 M END