MMs00485354 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 59 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 1.2952 0.7566 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2952 -0.4434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2875 2.2566 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2875 3.4566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5827 3.0133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8855 2.2699 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5750 4.5132 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8702 5.2699 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8309 5.8699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1730 4.5265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4682 5.2832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7711 4.5399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0663 5.2965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8625 6.7699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1577 7.5265 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0154 3.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3105 2.2433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3029 0.7433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6134 2.9867 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6134 1.7867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6211 4.4866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9239 5.2300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9316 6.7300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2345 7.4733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5297 6.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5220 5.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2191 4.4733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8325 7.4600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0133 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6053 1.0361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0361 -0.6053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6053 -1.0361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5327 5.1079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4064 3.6034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9491 3.6113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6922 6.1985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2349 6.2064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0045 3.6167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5471 3.6246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2902 6.2118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8329 6.2197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3753 3.3532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0215 4.1999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4383 4.2843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2164 5.6164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8955 7.3353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2406 8.6733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5581 4.6114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2130 3.2733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8387 8.6600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9509 2.8247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6042 -1.1867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3691 4.5532 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4053 5.1585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5596 7.5132 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9086 2.2300 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9024 1.0300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5535 8.7132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 30 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 17 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 14 54 1 0 0 0 0 15 16 2 0 0 0 0 15 56 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 57 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 30 53 1 0 0 0 0 43 54 1 0 0 0 0 52 57 1 0 0 0 0 54 55 1 0 0 0 0 56 59 1 0 0 0 0 57 58 1 0 0 0 0 M END