MMs02943191 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 55 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 0.7463 -1.3012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0074 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7388 -3.8992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2388 -3.9035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9926 -2.6066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2463 -1.3055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0086 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.5074 -2.5938 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2611 -3.8907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5149 -5.1918 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7611 -3.8864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5074 -2.5852 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.0074 -2.5809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8926 -3.7919 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3178 -3.3243 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3135 -1.8243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8856 -1.3649 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4180 0.0604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4185 1.1780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9509 2.6032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5245 -0.9392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8966 -1.5453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1076 -0.6602 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.4796 -1.2664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6407 -2.7577 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.6906 -0.3812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.1185 -0.8407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.9967 0.3754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.1116 1.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.6863 1.1188 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0409 0.5970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 1.0409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0409 -0.5970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1359 -4.9368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8359 -4.9445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1925 -2.6101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1045 -1.5528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5561 -5.0687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8899 -4.2936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3601 -0.5060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6765 1.0039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5930 0.9318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7764 2.8494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7513 3.4973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6589 -0.1080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1927 0.0576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2284 -2.5421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7622 -2.3765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9787 0.5329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.4926 -1.9809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.1967 0.3788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.4791 2.7287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 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 9 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 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 38 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 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 27 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 51 1 0 0 0 0 29 30 2 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 30 53 1 0 0 0 0 M END