MMs01146951 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 54 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 -0.0065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2444 -1.3087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4888 -2.6045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2331 -3.9068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7331 -3.9133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4887 -2.6175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7444 -1.3152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4775 -5.2155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7219 -6.5113 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9775 -5.2220 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7331 -3.9262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2331 -3.9327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1200 -2.7230 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5446 -3.1927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5381 -4.6927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1095 -5.1500 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.7619 -2.3163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6115 -0.8238 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1296 -2.9323 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.3469 -2.0559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7146 -2.6719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1965 -0.5634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7219 -6.5243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2219 -6.5308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9663 -7.8201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0052 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0052 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2967 1.1762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6294 0.3991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2888 -2.5993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6287 -4.9434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6887 -2.6227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3488 -0.2786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6073 -3.5109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9466 -2.7454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5059 -5.4022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2498 -4.1262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3861 -1.4559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2217 -3.7660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8087 -3.1647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2074 -1.5777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3905 -0.4431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0763 0.6305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0026 -0.6837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3219 -7.5635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2167 -7.7308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4219 -6.5359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2271 -5.3308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9296 -7.2156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3618 -8.8567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0029 -8.4246 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 2 30 1 0 0 0 0 2 31 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 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 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 34 1 0 0 0 0 8 35 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 24 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 38 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 39 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 M END