MMs00727490 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 45 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 1.3028 0.7435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0130 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9008 0.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9083 2.2305 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4988 0.7176 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7867 -1.5388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0819 -2.2953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3847 -1.5518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0969 0.7047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6800 -2.3082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9827 -1.5647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2780 -2.3212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5733 -3.0777 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9902 -0.0648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6949 0.6917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2930 0.6788 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.3005 2.1787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6032 2.9223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6107 4.4222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3154 5.1787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0126 4.4352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0052 2.9352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3229 6.6787 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.5948 1.0422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0422 -0.5948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5948 -1.0422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5360 1.6666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0787 1.6589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4202 -0.9413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9628 -0.9490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7444 -2.1336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0760 -3.4953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9133 0.2456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1029 1.9047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6740 -3.5082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3292 0.0736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6394 2.3171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6529 5.0171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9764 5.0404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9630 2.3404 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 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 3 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 40 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 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 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 43 1 0 0 0 0 26 44 1 0 0 0 0 M END