MMs02094696 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 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 -1.5000 0.0064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2444 1.3087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4888 2.6045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0111 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7556 1.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2556 1.2894 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2555 1.2765 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5111 2.5788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0111 2.5852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7555 1.2701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6320 0.0528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0605 0.5102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0670 2.0102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6424 2.4798 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2765 3.6227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2843 2.8866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7088 2.4170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5957 3.6267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7193 4.8440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2907 4.3866 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.1663 0.9884 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.1623 -1.3718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6927 -2.7964 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7444 1.3151 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.5955 -1.0418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1044 -1.0302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0844 3.6463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6156 3.6347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8706 -0.4185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2033 -1.1955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2865 -1.2002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6258 -0.4346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6405 2.9843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3078 3.7614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8853 3.0004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2246 3.7660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0283 -0.1993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7957 3.6216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0950 5.9837 0.0000 H 0 0 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 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 20 24 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 25 26 3 0 0 0 0 M END