MMs00444589 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 0 0 1 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 1.2066 -0.8912 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0475 -1.2017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0381 -2.3817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2447 -3.2728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6197 -2.6735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7882 -1.1830 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5816 -0.2918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1633 -0.5836 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5639 0.7914 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7626 -1.9587 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5383 0.0157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8314 -0.7445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9540 0.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3547 1.6255 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.8617 1.4804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4187 -0.0729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8711 -1.5031 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4311 1.0339 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8959 0.7106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9083 1.8174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3730 1.4940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8253 0.0638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8129 -1.0430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3482 -0.7196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2901 -0.2595 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.7129 0.9653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9653 0.7129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7129 -0.9653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1128 -2.0419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5036 -3.4561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 -4.0996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9079 -4.2729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9009 -3.8401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8174 -2.5992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9184 0.7083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4514 0.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9475 -1.9388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0657 2.3785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0693 2.1781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5464 2.9615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1829 2.3795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1748 -2.1871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5383 -1.6051 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 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 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 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 16 2 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 M END