MMs01611849 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 43 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 0.7422 1.3035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0156 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5156 2.5890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2578 1.2855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 -0.0090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2734 3.8835 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7661 4.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0868 5.4967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7923 6.2545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6715 5.2575 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5161 5.9516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8368 7.4169 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6248 4.9412 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3041 3.4759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8747 3.0210 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.0541 5.3962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1628 4.3858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8421 2.9205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.5921 4.8407 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.7008 3.8304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3801 2.3650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4888 1.3547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9181 1.8096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2388 3.2749 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.1301 4.2853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4508 5.7506 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6062 -1.0356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9422 1.3107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5781 3.6408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4577 1.2783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0937 -1.0518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6740 7.4486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1910 2.6676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4971 6.4591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0042 6.1293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8487 6.0130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2366 2.0011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2322 0.1824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8051 1.0013 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 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 7 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 37 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 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 M END