MMs02762818 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 55 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 1.3027 -0.7437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 -2.2437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6126 -2.9873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9080 -2.2310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9007 -0.7311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2107 -2.9747 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5060 -2.2184 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5453 -1.6184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8087 -2.9621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4988 -0.7184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0252 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0379 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7869 1.5378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4842 2.2815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4769 3.7815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7723 4.5378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0749 3.7941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0822 2.2941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3849 1.5505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 0.0505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6948 -0.6932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9902 0.0631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9829 1.5631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6803 2.3068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2179 -4.4747 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.7179 -4.4674 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7180 -4.4820 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2252 -5.9747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5949 1.0421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0421 0.5949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5949 -1.0421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2736 -2.8487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6184 -4.1873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4189 -0.4285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5922 1.2126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2138 -4.0042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8508 -3.5570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4037 -1.9200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8363 -0.5571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4479 1.6765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4348 4.3765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7664 5.7378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1112 4.3992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3559 -0.5546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7007 -1.8932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0324 -0.5318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0192 2.1681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6744 3.5067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0253 -5.9805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2311 -7.1747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4252 -5.9689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 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 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 37 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 11 1 0 0 0 0 9 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 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 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 29 2 0 0 0 0 27 30 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 M END