MMs01359155 MOE2007 2D CORINA 3.40 0006 02.08.2006 45 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 1.2977 0.7523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8958 0.7569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0092 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4939 0.7615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4912 2.2615 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0919 0.7661 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 0.0184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3949 -1.4816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6900 0.7707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9904 0.0230 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9930 -1.4770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2881 0.7753 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.5358 2.0730 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0404 -0.5224 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5858 1.5276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8861 0.7800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1838 1.5323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1812 3.0323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8808 3.7799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5831 3.0276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4789 3.7846 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.6018 1.0382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0382 -0.6018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6018 -1.0382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5247 1.6702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0674 1.6729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8284 -0.9160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3710 -0.9133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1228 1.6748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6655 1.6775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1983 -1.1908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0245 -0.9068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5672 -0.9041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9170 1.6886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4597 1.6914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7930 -1.4791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9951 -2.6770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1930 -1.4748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8883 -0.4200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2241 0.9341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8787 4.9799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5428 3.6258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 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 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 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 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 M END