MMs01475215 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 45 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 0.7425 -1.3033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2425 -1.3120 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9850 -2.6153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2276 -3.9100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9701 -5.2133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4700 -5.2219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2275 -3.9272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4850 -2.6239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2424 -1.3292 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7424 -1.3378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4849 -2.6412 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 -0.0431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 -0.0518 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7573 1.2429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0148 2.5463 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2573 1.2343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9998 -0.0690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4998 -0.0776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2572 1.2171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5147 2.5204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0147 2.5290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2722 3.8151 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.9775 4.5726 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5669 3.0576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0296 5.1098 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.7572 1.2084 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0427 0.5940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 1.0427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0427 -0.5940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3875 -1.7073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9441 -2.4863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0276 -3.9031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3641 -6.2491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0641 -6.2646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4275 -3.9341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6484 -0.2865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3746 0.3738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7150 1.1374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3938 -1.1048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0938 -1.1203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4207 3.5717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2296 5.1029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4356 6.1525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 27 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 M END