MMs01268633 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 1.4742 -0.2771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1165 -1.6326 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6042 -1.4405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7424 -2.4176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1576 -1.9204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4346 -0.4462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2965 0.5308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8813 0.0337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5648 0.7527 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.8499 0.0509 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9880 -0.9261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7109 -2.4003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4032 -0.4290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5414 -1.4060 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.5414 -0.2060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9566 -0.9089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2337 0.5653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6489 1.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7870 0.0854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5100 -1.3888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0948 -1.8859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2643 -2.8802 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.4025 -3.8572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8177 -3.3601 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1254 -5.3314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2217 1.1794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1794 0.2217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2217 -1.1794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5207 -3.5969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0681 -2.7020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5181 1.7102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0715 1.2303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8150 0.6169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3311 0.3320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3231 1.3470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8705 2.2418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9192 0.4832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4205 -2.1704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9839 -2.4756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1321 -3.2779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9460 -5.1098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9037 -6.5108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3048 -5.5531 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 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 33 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 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 23 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 M END