MMs01652236 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 46 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 -1.3031 -0.7428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3114 -2.2428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0165 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2866 -2.2571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2949 -0.7571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5815 -3.0142 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.3387 -1.7193 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8244 -4.3091 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8764 -3.7714 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0250 -5.2640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4905 -5.5839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2476 -4.2890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2501 -3.1688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6145 -2.9857 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9094 -2.2285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9012 -0.7286 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2126 -2.9714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2208 -4.4714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5240 -5.2142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8189 -4.4571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8106 -2.9571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5075 -2.2143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2346 -2.4857 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -10.1230 -3.6944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2480 -4.9127 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0066 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3391 -0.1371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0231 -4.1999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3374 -0.1629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 -5.2574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8930 -6.4567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1134 -6.7231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5841 -6.0780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2146 -4.9997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0555 -3.4017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6558 -2.1263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2248 -2.4688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6211 -4.1857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1849 -5.0771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5306 -6.4142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5009 -1.0143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3229 -3.6878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 15 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 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 23 2 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 M END