MMs01359732 MOE2007 2D CORINA 3.40 0006 02.08.2006 61 64 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 0.0065 -1.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0327 -0.9000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2893 -2.2556 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6893 -3.2948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1388 -3.1794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3545 -3.6533 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5136 -3.9639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4564 -2.5844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7288 -1.6859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6939 -2.5824 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6939 -1.3824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4221 -5.0341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3088 -2.2444 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6045 -1.4887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0112 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9068 -2.2331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2026 -1.4775 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5049 -2.2219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5114 -3.7219 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8006 -1.4663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1029 -2.2106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3987 -1.4550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 0.0450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0899 0.7893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4919 0.7781 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7010 -2.1994 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.4453 -0.8971 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9566 -3.5017 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0032 -2.9438 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2990 -2.1882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6013 -2.9325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8971 -2.1769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8906 -0.6769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5883 0.0674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2925 -0.6882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1864 0.0787 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0052 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0208 -3.6154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1389 -4.3794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2659 -3.4703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3661 -1.8017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6529 -0.9204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9531 -0.7703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5298 -5.4956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5298 -5.8365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3139 -3.4443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1394 -3.1557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6821 -3.1490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1081 -3.4106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4288 0.6494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0847 1.9893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4867 1.9781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0084 -4.1438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6065 -4.1325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9389 -2.7724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5831 1.2674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2507 -0.0927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 14 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 1 0 0 0 0 9 44 1 0 0 0 0 9 45 1 0 0 0 0 10 11 1 0 0 0 0 10 46 1 0 0 0 0 10 47 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 14 15 1 0 0 0 0 14 50 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 51 1 0 0 0 0 17 52 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 24 25 2 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 27 56 1 0 0 0 0 28 29 2 0 0 0 0 28 30 2 0 0 0 0 28 31 1 0 0 0 0 31 32 1 0 0 0 0 31 57 1 0 0 0 0 32 33 1 0 0 0 0 32 37 2 0 0 0 0 33 34 2 0 0 0 0 33 58 1 0 0 0 0 34 35 1 0 0 0 0 34 59 1 0 0 0 0 35 36 2 0 0 0 0 35 38 1 0 0 0 0 36 37 1 0 0 0 0 36 60 1 0 0 0 0 37 61 1 0 0 0 0 M END