IFLAB-ZINC01781099 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 0 0 0 0 0 0999 V2000 0.0140 1.4970 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.0330 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -0.5570 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3950 -2.0870 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8320 -2.6100 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8190 -4.0390 0.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0250 -4.6680 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0840 -6.0540 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3080 -6.6930 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4800 -5.9480 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4200 -4.5610 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1950 -3.9230 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7220 -6.5960 0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.8780 -7.7560 -0.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9200 -8.2830 -1.1680 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0940 -8.3310 -0.7130 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.2380 -9.5820 -1.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1700 -10.4900 -0.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3100 -11.7240 -1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5250 -12.0570 -2.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5960 -11.1550 -3.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4550 -9.9160 -2.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6110 -11.5770 -4.3820 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 1.8700 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5030 1.8530 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 1.8580 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 -0.3940 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 -0.3890 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9270 -0.1960 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9260 -0.2010 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8770 -2.4480 -0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 -2.4430 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3500 -2.2490 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3490 -2.2540 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1720 -6.6330 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3540 -7.7720 0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3310 -3.9810 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1480 -2.8440 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4710 -6.2100 0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8690 -7.8780 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7840 -10.2320 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0340 -12.4300 -1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6370 -13.0230 -2.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7330 -9.2100 -2.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 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 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 44 1 0 0 0 0 M END