MMs02119059 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 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 0.7599 -1.2933 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2599 -1.2818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 0.0230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2598 -1.2588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5198 -2.5636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0198 -2.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7597 -1.2473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5197 -2.5406 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0196 -2.5291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7795 -3.8224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2795 -3.8109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7539 -5.2339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5472 -6.1248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3270 -5.2525 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.0195 -2.5061 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2596 -1.2129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7597 -1.2244 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9996 0.0919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2397 1.3851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9798 2.6899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4797 2.7013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2396 1.4081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4996 0.1033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2595 -1.1899 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0346 0.6079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6079 1.0346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0346 -0.6079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3920 1.0576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0919 1.0782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1277 -3.5982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4278 -3.6188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5423 -0.0672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8842 -0.8283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9276 -3.5844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8980 -5.5960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5564 -7.3248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0398 1.3759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3718 3.7245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0717 3.7451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4396 1.4173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 19 2 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 M END