MMs01019319 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 43 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 1.3054 -0.7388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3183 -2.2388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6238 -2.9776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9163 -2.2164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9034 -0.7165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0447 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5014 -0.6942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5143 -2.1941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7939 0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0994 -0.6718 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1123 -2.1718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3919 0.0893 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.6308 1.3819 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1531 -1.2032 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6845 0.8504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6716 2.3504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9641 3.1115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2696 2.3727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2824 0.8728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9899 0.1116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3144 -1.3528 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.8074 -1.4968 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 15.4057 -0.1213 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 1.0443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0443 0.5910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5910 -1.0443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2843 -2.8477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6341 -4.1775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9607 -2.8075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5877 1.2223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1856 1.2446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0147 0.9796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5574 0.9928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9123 -2.1821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1226 -3.3717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3122 -2.1615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6272 2.9414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9538 4.3115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3036 2.9816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 13 38 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 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 25 2 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 M END