IFLAB-ZINC04554165 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 60 0 0 1 0 0 0 0 0999 V2000 -1.2090 1.8260 1.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 0.3820 1.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4230 -0.4790 1.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 -1.8030 1.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 -2.2660 0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 -1.4050 -0.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2850 -0.0820 -0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2270 -3.9540 -0.0580 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -3.9780 -1.4470 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 -4.4690 0.9350 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6640 -4.7560 0.1250 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5080 -5.0540 -1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9190 -4.5160 -0.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4420 -5.0890 0.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5340 -4.6430 1.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1170 -5.1880 1.4540 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1290 -6.2770 1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1700 -4.6370 2.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6980 -5.0040 3.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 -4.5870 4.9280 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 -4.8100 6.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0160 -5.3560 6.5640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -4.3840 7.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 -3.8380 6.9370 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 -4.6070 8.5740 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -4.1900 9.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 -4.5570 10.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2520 -4.2360 12.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0790 -3.7520 11.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3230 2.4140 1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0590 2.2010 0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4220 1.9050 2.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1760 -0.1180 2.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -2.4760 2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3030 -1.7670 -1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7120 0.5900 -0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 -4.5740 -1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5520 -6.1330 -1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8870 -3.4280 -0.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5790 -4.8140 -1.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4550 -4.7270 0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4510 -6.1770 0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5060 -3.5540 1.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9210 -5.0320 2.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 -5.0670 2.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 -3.5520 2.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6480 -4.4980 4.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8460 -6.0820 3.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -4.1500 4.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 -5.0440 8.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 -4.6960 9.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -3.1120 9.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -5.6220 11.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 -3.1710 12.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 -4.4970 13.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1550 -4.8100 11.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8360 -3.9810 10.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4550 -4.0130 12.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8480 -2.6870 11.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 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 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 M END