MMs00693908 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 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 0.2257 -1.4829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6227 -2.0290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7942 -1.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5685 0.3908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1714 0.9369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9091 1.0637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9633 -0.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2742 -1.3357 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.4463 0.2223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9923 1.6194 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3831 -0.9492 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8661 -0.7235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8030 -1.8949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2859 -1.6693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8319 -0.2722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8950 0.8992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4121 0.6736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3149 -0.0465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3691 -1.1136 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.1742 -2.2977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7097 -0.4408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1068 -0.9868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2782 -0.0499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0525 1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6555 1.9791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4840 1.0422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0040 1.2858 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1528 2.5438 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.1177 0.4368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7115 -2.2324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8033 -3.2153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9909 2.1232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9463 -2.0668 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3661 -3.0126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0354 -2.6064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3319 2.0169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6626 1.6107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2873 -2.1732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.3959 -0.4868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9897 2.1825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4749 3.1654 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 28 2 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 26 2 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 27 28 1 0 0 0 0 M END