MMs00183629 MOE2007 2D CORINA 3.40 0006 02.08.2006 61 64 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 1.3050 -0.7396 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5861 1.5206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8791 2.2809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1841 1.5413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 -0.7190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5010 -0.6983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5129 -2.1982 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 0.0620 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0989 -0.6776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1109 -2.1776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4159 -2.9172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7089 -2.1569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6969 -0.6569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3920 0.0827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9900 0.1034 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2949 -0.6363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3069 -2.1362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5880 0.1241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5760 1.6240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8691 2.3843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1740 1.6447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1860 0.1447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8929 -0.6156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4909 -0.5949 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 20.2306 0.7101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7513 -1.8999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.7959 -1.3345 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 22.0889 -0.5742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.3939 -1.3139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.4058 -2.8138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.1128 -3.5741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8078 -2.8345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4670 2.4050 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.5917 1.0440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 0.5917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5917 -1.0440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5421 2.1123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8695 3.4809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2185 2.1496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9125 -1.9189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7844 1.2620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0765 -2.7858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4254 -4.1172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7529 -2.7486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3824 1.2827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5321 2.2157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8595 3.5843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9025 -1.8155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.3103 0.3389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.8529 0.3511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.7953 -0.1830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.5773 -1.5128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.5859 -2.5960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.8252 -3.9382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.8914 -4.4872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.3488 -4.4995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.6244 -2.6355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.4064 -3.9654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 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 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 6 7 2 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 43 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 44 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 15 16 2 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 2 0 0 0 0 24 36 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 29 2 0 0 0 0 27 30 1 0 0 0 0 30 31 1 0 0 0 0 30 35 1 0 0 0 0 31 32 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 32 33 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 33 34 1 0 0 0 0 33 56 1 0 0 0 0 33 57 1 0 0 0 0 34 35 1 0 0 0 0 34 58 1 0 0 0 0 34 59 1 0 0 0 0 35 60 1 0 0 0 0 35 61 1 0 0 0 0 M END