MMs01030919 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 54 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 0.4903 -1.4176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4923 -2.5510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9631 -1.7018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9457 -0.5684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4010 0.2807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8739 -0.0035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5096 -1.3621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9254 -2.7437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8297 -3.9404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3183 -3.7556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9025 -2.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9982 -1.1773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2824 0.2955 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9695 1.0210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7847 2.5095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4031 3.0938 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6410 0.9313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8709 0.0726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2295 0.7084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4594 -0.1504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3307 -1.6448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9721 -2.2806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7422 -1.4219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5606 -2.5035 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.1341 0.3922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3922 1.1341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1341 -0.3922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6688 -1.1070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 -1.7650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2783 -3.4577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4144 -3.3371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5346 -2.8227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9925 -2.3185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9162 0.0482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3742 0.5524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8296 1.4016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3716 0.8974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7345 -2.8915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3623 -5.0456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0418 -4.7130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0934 -2.2262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9514 1.9133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4884 1.7810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3325 1.9039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5463 0.3583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8691 -3.4762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6553 -1.9305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4185 -0.8527 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8107 -1.9868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9814 3.4139 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8336 4.6047 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 4 1 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 5 49 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 6 49 1 0 0 0 0 7 8 1 0 0 0 0 7 15 2 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 51 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 49 50 1 0 0 0 0 51 52 1 0 0 0 0 M END