MMs00522775 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 43 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 1.2945 -0.7578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0157 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8925 -0.7736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8834 -2.2735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4905 -0.7893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5087 2.2107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2051 1.4685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1067 2.1949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4012 1.4371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7047 2.1792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9992 1.4214 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.0421 2.0151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9901 -0.0786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2846 -0.8364 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6866 -0.8207 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6793 -2.0207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 -0.0629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0886 -0.8050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7138 3.6792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4193 4.4370 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6063 1.0356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0356 0.6063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6063 -1.0356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5176 -1.6724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0602 -1.6817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -1.2314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7136 -1.7039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2563 -1.7132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1977 -1.1772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9771 0.1541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7429 3.1346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2856 3.1252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0221 1.2673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8015 2.5986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8836 3.1095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3409 3.1189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8032 1.4528 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.0174 4.4213 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0246 5.6213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 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 10 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 9 40 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 41 42 1 0 0 0 0 M END