MMs02443011 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 57 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 0.7231 -1.3142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2228 -1.3450 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9460 -2.6592 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5460 -1.6199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4342 -2.8466 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5933 -3.1572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7159 -4.3199 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7159 -5.5199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4017 -5.0431 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3078 -4.0167 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9973 -5.1758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8345 -4.2983 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2593 -3.2719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5735 -3.9951 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2918 -5.4684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1964 -5.6558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7782 -7.0384 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1282 -8.2335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6165 -8.0461 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1983 -6.6636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6865 -6.4761 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.4536 -9.6161 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.0734 -4.9580 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1126 -5.5580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3048 -4.1015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6623 -4.7396 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8936 -3.8831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2511 -4.5212 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7675 -2.3884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1995 -6.4527 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5570 -7.0909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6831 -8.5855 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7884 -6.2343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4606 -1.7527 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0265 -0.3169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0529 0.7769 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5660 0.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0513 0.5785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5785 1.0513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0513 -0.5785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4127 -1.7013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9072 -2.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1094 -2.0813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4589 -3.2503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9961 -3.1206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9633 -2.2875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6666 -1.1926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5718 -2.4893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4736 -7.2194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7735 -5.5491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1031 -5.2492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8396 1.1934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3976 0.2986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2924 -1.1434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 42 1 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 35 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 24 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 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 44 1 0 0 0 0 15 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 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 31 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 47 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 31 32 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 34 50 1 0 0 0 0 34 51 1 0 0 0 0 34 52 1 0 0 0 0 35 36 1 0 0 0 0 36 37 2 0 0 0 0 36 38 1 0 0 0 0 38 53 1 0 0 0 0 38 54 1 0 0 0 0 38 55 1 0 0 0 0 M END