IFLAB-ZINC04059327 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 -0.0220 1.8060 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 -0.3060 1.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3590 0.5990 2.3200 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9510 0.0270 3.3070 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8950 -1.2680 3.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -1.5290 2.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9050 -2.7880 1.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 -3.1770 0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 -4.4170 -0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3060 -5.2710 0.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -4.8860 1.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -3.6480 2.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3160 -5.9600 2.4680 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.4720 -2.2890 4.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 -2.6410 5.1290 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 -3.5430 6.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8620 -4.0640 6.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -3.8980 7.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0550 -4.8320 8.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -5.1600 9.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1420 -4.5660 9.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 -3.6380 8.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 -3.2970 7.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6710 -3.0620 8.0060 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.1830 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1670 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1570 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1230 -2.5110 -0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5870 -4.7200 -1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -6.2400 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3730 -3.3490 3.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7560 -3.1820 3.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3510 -1.8730 4.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -2.2250 5.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 -5.2970 8.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 -5.8820 9.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8800 -4.8270 9.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7450 -2.5710 6.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 15 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 2 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 39 1 0 0 0 0 M END