MMs03534338 MOE2007 2D CORINA 3.40 0006 02.08.2006 56 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 -0.0117 -1.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2814 -2.2601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5863 -1.5203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0203 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8794 -2.2804 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1843 -1.5406 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1843 -2.7406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5009 0.6992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5126 2.1991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8174 2.9390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1106 2.1788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0989 0.6789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -0.0609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4774 -2.3007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6225 -3.7937 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7245 -4.5896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0873 -4.1170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8271 -5.4219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3270 -5.4336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0872 -4.1405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3474 -2.8356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8474 -2.8239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8524 -1.7013 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3166 -2.2398 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.0564 -0.9349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5768 -3.5446 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6215 -2.9796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9146 -2.2195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2194 -2.9593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2312 -4.4592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9380 -5.2194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6332 -4.4795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5360 -5.1991 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -0.0094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0094 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5029 -3.1733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0455 -3.1853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8700 -3.4804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0126 -0.2398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7944 1.0902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4781 2.8073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8268 4.1389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1545 2.7707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1334 0.0708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7893 -0.6609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2190 -6.4564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9189 -6.4775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2871 -4.1498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9555 -1.8011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9052 -1.0195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2540 -2.3512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9474 -6.4193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5987 -5.0877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 16 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 13 14 2 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 25 2 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 22 23 2 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 26 27 2 0 0 0 0 26 28 2 0 0 0 0 26 29 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 53 1 0 0 0 0 31 32 1 0 0 0 0 31 54 1 0 0 0 0 32 33 2 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 33 55 1 0 0 0 0 34 56 1 0 0 0 0 M END