IFLAB-ZINC04275823 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5850 -0.6640 -1.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 -0.0440 -1.9320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -2.1300 -1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -2.9440 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -4.2450 -0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 -4.5420 -1.7030 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 -2.8760 -2.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7930 -2.3480 -3.1480 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 -3.1700 -4.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2510 -4.3750 -3.9310 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9820 -2.6080 -5.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0640 -1.2240 -5.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6840 -0.7050 -6.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2250 -1.5520 -7.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1490 -2.9230 -7.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5350 -3.4570 -6.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4460 -5.1790 -6.0280 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 -0.4990 0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -2.5340 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 -5.0180 0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8480 -1.3870 -3.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 -0.5620 -4.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7470 0.3650 -6.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7090 -1.1390 -8.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5730 -3.5780 -8.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 9 2 0 0 0 0 6 7 2 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 16 17 2 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 M END