IFLAB-ZINC04138059 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 1.4640 1.0710 3.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 -0.3570 2.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 -1.4060 3.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 -2.5940 2.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 -3.9520 2.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -4.8350 1.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 -4.3930 0.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9940 -3.0580 0.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 -2.1410 1.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 -0.7770 1.4250 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3640 -0.2000 0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4840 -6.3010 2.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 -6.5880 2.2470 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 -7.8430 2.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 -8.7370 2.6630 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8310 -8.1320 2.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6630 -7.4140 3.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0140 -7.6890 3.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5450 -8.6740 2.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7260 -9.3900 1.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3740 -9.1200 1.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 -9.8810 0.7860 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.9500 -10.8250 0.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3320 -9.5640 0.6540 O 0 5 0 0 0 0 0 0 0 0 0 0 2.5250 1.2750 3.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0630 1.7420 2.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 1.2270 4.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 -1.3780 4.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 -4.3040 3.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -5.1030 -0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -2.7240 -0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 -6.8920 1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 -6.5560 3.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5940 -5.8740 2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2500 -6.6460 4.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6590 -7.1350 4.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6040 -8.8860 2.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1470 -10.1570 1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 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 21 2 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END