IFLAB-ZINC05147948 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 0.6460 1.3610 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -0.0670 -0.0250 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -0.7330 1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 -2.0890 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 -2.7440 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 -3.9320 -0.1000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 -2.0430 -1.2080 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 -2.4920 -2.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 -0.7310 -1.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2740 -0.1310 -2.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 -2.4860 2.4970 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -1.3840 3.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 -0.3550 2.4580 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -1.3480 4.6260 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 0.0300 5.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 0.0190 6.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 -1.9930 6.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 -1.9820 5.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 -3.8320 2.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9730 -3.9410 3.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8330 -4.4550 2.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1850 -4.5550 2.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6780 -4.1420 3.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8170 -3.6280 4.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4640 -3.5330 4.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4340 -3.1090 6.3210 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -6.3760 -4.2680 4.1690 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.7290 1.4880 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 1.8220 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 1.8370 0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 0.6150 4.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 0.4740 4.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 1.0430 7.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 -0.5430 6.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 -2.5780 7.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1650 -2.4370 7.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3640 -3.0060 4.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1730 -1.4200 4.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 -4.5660 2.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -4.0200 3.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4480 -4.7770 1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8560 -4.9560 1.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7910 -3.1360 5.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 -0.6150 7.1720 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9420 -0.0720 6.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 19 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 18 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 17 44 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 43 1 0 0 0 0 44 45 1 0 0 0 0 M END