MMs00798786 MOE2007 2D CORINA 3.40 0006 02.08.2006 32 33 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 1.3716 -0.6072 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5833 0.2770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4233 1.7685 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9549 -0.3302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1665 0.5541 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5381 -0.0532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8531 -1.5197 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3452 -1.6734 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9524 -0.3018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8356 0.6996 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9892 2.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4190 0.0132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8795 1.4408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3460 1.7557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3521 0.6431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8916 -0.7844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4250 -1.0994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9645 -2.5269 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 14.8187 0.9581 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.4858 1.0973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0973 0.4858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4858 -1.0973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4996 -1.8004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2859 -1.3264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8198 -1.1619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1829 2.0688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1121 3.3854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7955 2.3146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0747 2.3308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7145 2.8978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6964 -1.6745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 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 12 27 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 31 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 17 32 1 0 0 0 0 18 19 1 0 0 0 0 M END