MMs03842688 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 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 -1.2950 -0.7570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 -0.0141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6062 1.4859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3112 2.2429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0081 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2868 2.2570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2787 3.7570 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5899 1.5141 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8849 2.2711 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8849 1.0711 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8767 3.7711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1717 4.5281 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1879 1.5281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4829 2.2852 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7860 1.5422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0972 -0.7007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 0.0563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8212 -0.3995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6963 0.8188 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.8081 2.0276 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.1727 3.1708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3840 1.5563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0809 2.2993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0352 1.9417 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4122 3.0809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9103 0.7234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0221 -0.4853 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0425 -0.5944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2884 -1.9570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3177 3.4429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5964 0.3141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6961 3.5563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4602 4.8965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1652 5.7281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4764 3.4852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7582 -0.5634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1037 -1.9007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1982 -1.5387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0744 3.4992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1103 0.7169 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 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 34 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 14 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 26 2 0 0 0 0 18 19 2 0 0 0 0 18 39 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 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 42 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 2 0 0 0 0 29 43 1 0 0 0 0 M END