MMs00956325 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 1.3029 0.7433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9009 0.7301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4989 0.7168 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7865 -1.5398 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0970 0.7035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6950 0.6902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9902 -0.0664 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2931 0.6769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3007 2.1769 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5883 -0.0797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8911 0.6636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1863 -0.0930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1786 -1.5930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8758 -2.3363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5806 -1.5797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2777 -2.3230 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2716 -3.5230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9825 -1.5664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6797 -2.3098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.4892 0.6504 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.5947 1.0423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0423 -0.5947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5947 -1.0423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8220 -0.9286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3647 -0.9365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1343 1.6532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6769 1.6454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4200 -0.9419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9627 -0.9498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5051 1.9168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3303 1.6267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8730 1.6188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6161 -0.9684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1588 -0.9763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9284 1.6134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4711 1.6055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8972 1.8636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2148 -2.1983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8696 -3.5363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 23 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 20 2 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 M END