MMs03514061 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 44 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 1.5000 -0.0084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2427 -1.3116 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0427 -1.3116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4854 -2.6064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7427 -1.3201 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4854 -2.6233 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0854 -3.6625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9853 -2.6317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7281 -3.9181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4708 -5.2213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7572 1.2780 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 -0.0337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7572 1.2612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2572 1.2527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0144 2.5476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5144 2.5391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2571 1.2359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4998 -0.0589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 -0.0505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7571 1.2275 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0067 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0067 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2982 1.1745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6299 0.3957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4496 -2.0006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8796 -3.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0033 -2.9094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9786 -3.8317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1853 -2.6384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9921 -1.4317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2706 -3.5298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8045 -4.6843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4282 -5.8155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0649 -6.2639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5134 -4.6272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5941 -1.0762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1630 2.3037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4203 3.5901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1202 3.5750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0940 -1.1015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3940 -1.0863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 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 28 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 44 1 0 0 0 0 M END