IFLAB-ZINC01772485 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 0 0 0 0 0 0999 V2000 0.9140 1.2230 0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 -0.2760 0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 -1.0120 1.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 -2.4020 1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -3.0680 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 -2.3460 -1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -0.9500 -1.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -0.1520 -2.1030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.7890 -3.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2740 0.2950 -4.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 -0.3040 -5.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 0.7490 -6.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 1.9450 -6.6300 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2830 0.1560 -8.1360 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 0.7910 -9.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 -0.0410 -10.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8640 0.4960 -11.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9860 1.8740 -11.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 2.7350 -10.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 2.1750 -9.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0110 4.2330 -11.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 4.9580 -9.9640 O 0 5 0 0 0 0 0 0 0 0 0 0 1.6940 1.6840 -0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 1.5540 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 1.5880 1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 -0.5060 2.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5170 -2.9650 2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 -4.1510 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -2.9050 -1.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 -1.3420 -3.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 -1.4710 -3.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6130 0.8810 -4.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 1.0050 -4.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 -0.8700 -6.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7450 -0.9970 -5.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2170 -0.8550 -8.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 -1.1200 -10.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9510 -0.1560 -12.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1670 2.2880 -12.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 2.8530 -8.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 4.6540 -12.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 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 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 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 36 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 2 0 0 0 0 M CHG 1 22 -1 M END