MMs01080991 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 42 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 1.5000 0.0087 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2425 1.3120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4850 2.6067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2274 3.9101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7274 3.9187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4849 2.6240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7424 1.3207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7574 -1.2773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0347 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7574 -1.2600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2574 -1.2513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0149 -2.5460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5148 -2.5373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2573 -1.2340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4998 0.0607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9998 0.0520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7573 -1.2253 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.7486 0.2747 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7660 -2.7253 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2573 -1.2166 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 14.8633 -2.2524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9849 2.6327 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7274 3.9361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0069 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0069 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 2.5998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6214 4.9458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3214 4.9614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5939 1.0774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6322 -1.6769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9726 -2.4405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4209 -3.5887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1208 -3.5731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0938 1.1034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3939 1.0878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7700 3.3421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3213 4.9788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6847 4.5301 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 M CHG 1 22 -1 M END