IFLAB-ZINC05258821 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 41 0 0 1 0 0 0 0 0999 V2000 -0.0060 1.5160 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -0.0130 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 -0.5030 -1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 -2.0330 -1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 -2.5230 -2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1580 -4.4990 -3.7360 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9460 -3.8400 -4.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -5.9080 -4.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 -5.8460 -4.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -4.7800 -4.4180 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 -6.9750 -4.7300 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -6.9320 -4.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4290 -5.8240 -5.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7970 -5.8280 -5.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5410 -6.9220 -5.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9660 -7.9550 -4.8200 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6660 -7.9950 -4.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6450 -4.5440 -3.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0950 -4.1890 -2.4310 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 1.8950 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 1.8790 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 1.8660 0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5480 -0.3760 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0060 -0.3920 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1950 -0.1410 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7490 -0.1250 -1.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 -2.3950 -0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2730 -2.4120 -1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -2.1610 -3.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4820 -2.1440 -2.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2150 -6.3190 -4.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 -6.5450 -3.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -7.8170 -4.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8230 -4.9830 -5.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2770 -4.9860 -6.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6080 -6.9310 -5.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2310 -8.8610 -4.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4820 -3.9920 -2.5350 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9130 -4.3540 -1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4690 -4.9770 -4.4620 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4150 -4.9870 -4.2600 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 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 18 1 0 0 0 0 6 38 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 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 33 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 38 39 1 0 0 0 0 40 41 1 0 0 0 0 M END