MMs00988720 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 41 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 1.2963 -0.7547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8944 -0.7641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8889 -2.2641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5872 -3.0094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2909 -2.2547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5817 -4.5094 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.1852 -3.0188 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4870 -2.2735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4924 -0.7735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7833 -3.0282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0851 -2.2829 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4531 -2.8980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4609 -1.7869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7156 -0.4852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2473 -0.7917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5020 0.5100 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.5097 1.6211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8778 1.0060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7597 -4.3664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6413 -5.3660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1846 -4.8351 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4911 -6.3034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6038 1.0370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 0.6038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6038 -1.0370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6024 1.1906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9358 -0.1679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2495 -2.8509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1809 -4.2188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0086 -3.9447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5513 -3.9503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6538 -1.9167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2645 2.7957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9192 1.6022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3165 -6.5486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7364 -7.4781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6658 -6.0582 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 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 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 14 21 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 M END