MMs01791727 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 53 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 -0.7434 -1.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0131 -2.5980 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6131 -1.5588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5131 -2.5905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7304 -3.9008 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3304 -2.8616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2303 -3.9084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9738 -5.2112 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9869 -2.6131 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3921 -1.5709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4869 -2.6207 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8869 -1.5815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2303 -3.9235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7303 -3.9311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4737 -5.2339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7172 -6.5291 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2434 -1.3255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 -0.0227 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0262 -5.1961 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5261 -5.1885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2696 -3.8857 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2827 -6.4838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7827 -6.4762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5392 -7.7715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7957 -9.0743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2958 -9.0818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5392 -7.7866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0392 -7.7941 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5555 -8.8364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7173 -6.4989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2173 -6.5064 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0422 -0.5948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5948 1.0422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0422 0.5948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6666 -0.5361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6588 -2.0788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5191 -3.7905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7130 -2.5844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5070 -1.3905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1006 -4.3282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4327 -5.1063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5279 -2.7482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8600 -3.5263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3774 -5.4340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7392 -7.7654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4010 -10.1105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7010 -10.1241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9737 -5.2414 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7434 -1.3330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3486 -0.2968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5685 -6.2836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 20 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 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 2 0 0 0 0 16 49 1 0 0 0 0 18 19 2 0 0 0 0 18 50 1 0 0 0 0 20 21 1 0 0 0 0 20 31 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 32 2 0 0 0 0 49 52 1 0 0 0 0 50 51 1 0 0 0 0 M END