MMs00979648 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 44 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 1.0345 -1.0862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4924 -0.7333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5270 -1.8194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1036 -3.2585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9849 -1.4666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4083 -0.0276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8662 0.3253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9007 -0.7609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4773 -2.1999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0194 -2.5527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7151 -3.0472 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.9034 -2.1319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4001 -0.7188 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.3424 -2.5552 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.4286 -1.5207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9040 -1.7913 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.6173 -0.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0752 -0.1189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4986 1.3201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4640 2.4063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0061 2.0534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5827 0.6144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2301 -0.0339 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 17.1097 -1.2051 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.5676 -0.8522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8689 0.8276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8276 0.8689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8689 -0.8276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0351 -1.7503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5151 -2.1857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5806 0.8414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2049 1.4765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6807 -3.7039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6247 -3.7216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6649 1.6024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8027 3.5575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1785 2.9223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8499 -2.0185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7340 -0.5699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2853 0.3141 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 1 0 0 0 0 2 30 1 0 0 0 0 2 31 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 11 2 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 M END