MMs01397518 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 53 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 1.5000 0.0077 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2566 -1.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5133 -2.5904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2699 -3.8856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7699 -3.8779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5132 -2.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7566 -1.2799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0230 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7566 -1.2645 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7433 1.3335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2433 1.3412 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9866 2.6440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2300 3.9392 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4866 2.6517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2299 3.9546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7299 3.9622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4865 2.6670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7432 1.3642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2432 1.3565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9865 2.6747 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.9942 1.1747 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9789 4.1747 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4865 2.6824 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.2299 3.9852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7298 3.9929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6053 5.2109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.0342 4.7547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.0419 3.2547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6177 2.7839 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5265 -5.1731 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0061 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0061 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3133 -2.5965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6752 -4.9278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7132 -2.5689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8946 1.0591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6136 1.7382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9456 2.5163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6246 4.9907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3246 5.0045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3485 0.3280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6485 0.3142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0918 1.6462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1001 4.3899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4322 5.1680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2287 6.3503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.0014 5.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.0163 2.5543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 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 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 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 12 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 31 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 2 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 M END