MMs01529464 MOE2007 2D CORINA 3.40 0006 02.08.2006 36 37 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 -1.2947 -0.7574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2861 -2.2574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0172 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3119 -2.2425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3033 -0.7426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5894 1.5149 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9013 -0.7277 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4994 -0.7128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5080 -2.2128 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5809 -3.0148 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8842 -2.2723 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.6267 -3.5756 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1416 -0.9690 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1875 -1.5297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1961 -0.0297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4994 0.7128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7941 -0.0446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7855 -1.5446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4822 -2.2872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4736 -3.7871 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -9.0974 0.6979 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0069 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3374 -0.1634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -4.1999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3545 -2.8366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9082 -1.9277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4195 0.9446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9621 0.9534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5740 -4.2148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1603 0.5762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5062 1.9128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8213 -2.1505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0446 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 M CHG 1 36 -1 M END