MMs03535214 MOE2007 2D CORINA 3.40 0006 02.08.2006 62 62 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 1.2946 -0.7576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0153 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8926 -0.7729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8838 -2.2729 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4907 -0.7882 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8029 1.4541 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0887 -0.8035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 -0.0612 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6867 -0.8188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6779 -2.3188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9902 -0.0765 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.9509 0.5235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9990 1.4235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3024 2.1658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3112 3.6658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6147 4.4082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9093 3.6505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9004 2.1506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5970 1.4082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2127 4.3929 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.2215 5.8928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5250 6.6352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5338 8.1352 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 19.5073 3.6352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8107 4.3776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.1053 3.6199 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 14.2848 -0.8341 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2759 -2.3341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5705 -3.0917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9725 -3.0764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6061 1.0357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0357 0.6061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6061 -1.0357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5179 -1.6723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0605 -1.6814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4301 0.8932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9728 0.8841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4836 -1.9882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3120 -1.7182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8546 -1.7273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3992 1.1388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8160 1.2221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5952 2.5535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2756 4.2719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6217 5.6081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9361 1.5444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5900 0.2082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0386 5.6914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8178 7.0229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7269 6.0702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.7079 6.8366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7306 2.7205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.2732 2.7115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.4278 4.8395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.5875 5.2923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3275 -0.2402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3786 -2.0337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9298 -3.6703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5664 -4.1192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 30 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 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 47 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 30 31 1 0 0 0 0 30 59 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 33 62 1 0 0 0 0 M END