MMs00967451 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 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 0.7436 -1.3027 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2436 -1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2436 -1.3247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4872 -2.6201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9872 -2.6127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2309 -3.9081 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9745 -5.2108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7436 -1.3321 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 -0.0367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7563 1.2660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 -0.0441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7562 1.2513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1529 2.6246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7286 3.0951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4239 4.5638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5435 5.5620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9678 5.0915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2725 3.6228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5678 2.8664 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.6665 3.3491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2488 1.4007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2470 0.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7765 -1.1432 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 5.9996 5.0343 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0422 0.5949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5949 1.0422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0422 -0.5949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4051 1.0275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1050 1.0142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0821 -3.6622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9324 -5.8057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5694 -6.2529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0167 -4.6159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3385 -2.3742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7857 -1.2248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1255 -0.4600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8329 2.2965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2998 6.7370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8635 5.8901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7157 0.5858 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 24 2 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 40 1 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 43 2 0 0 0 0 M CHG 1 26 -1 M END