MMs01544314 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 52 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 0.7572 -1.2949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0144 -2.5980 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7716 -3.8929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2716 -3.8846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0287 -5.1795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5287 -5.1711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2715 -3.8680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5143 -2.5731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0143 -2.5814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4856 -2.6063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2284 -3.9095 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2428 -1.3115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7427 -1.3198 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6177 -2.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1463 -3.9622 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0468 -2.0826 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.0551 -0.5826 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6311 -0.1112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1755 1.3180 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5949 -3.4788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5384 -2.2411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1469 -3.6122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6385 -3.7707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5216 -2.5582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9131 -1.1872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4215 -1.0286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8130 0.3424 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0359 0.6057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6057 1.0359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5179 -0.3029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6722 -0.5184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6807 -2.0611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3538 -4.3096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9865 -5.0735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4345 -6.2220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1345 -6.2070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4715 -3.8613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1086 -1.5306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4086 -1.5455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6801 -1.1032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4577 -0.1309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0298 0.1174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7119 -3.0404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8142 -4.0374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4779 -3.9173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7937 -4.0971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1253 -4.8675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7149 -2.6851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6196 -0.2172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 M END