MMs02058934 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 60 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 1.2868 2.2570 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 3.8930 0.7711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0281 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4910 0.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4829 2.2851 0.0000 O 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 7.8022 -1.4578 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0891 0.7992 0.0000 N 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 11.6871 0.8133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9902 0.0704 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.9510 -0.5296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9983 -1.4296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3014 -2.1726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5964 -1.4155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5882 0.0844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2851 0.8274 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2770 2.3274 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.7770 2.3192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7770 2.3355 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2689 3.8273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9658 4.5703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9577 6.0703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2527 6.8273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5557 6.0843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5639 4.5844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6056 1.0360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 -0.6056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6056 -1.0360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2557 1.3570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4868 2.2635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2803 3.4570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0869 2.2505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8317 -0.9093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3744 -0.9010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1167 1.6862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6594 1.6945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2026 -1.1718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0826 1.9992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6258 -0.8671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1685 -0.8588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9108 1.7284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4535 1.7367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8154 -1.2276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5940 -2.5595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5350 -3.0960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0777 -3.0876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0129 -2.5409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7770 -1.2008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7711 -0.1175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9925 1.2143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9299 3.9647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9152 6.6646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2462 8.0273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5917 6.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6063 3.9900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 19 20 1 0 0 0 0 19 53 1 0 0 0 0 19 54 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 27 28 2 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 28 58 1 0 0 0 0 29 59 1 0 0 0 0 M END