IFLAB-ZINC04072472 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 0.0330 1.4050 0.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 0.0240 0.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 -0.6480 0.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4470 0.0570 0.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 1.4490 0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 2.1100 0.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6470 1.9750 0.3810 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6540 1.1680 0.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1160 -0.4900 0.5770 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0580 1.5800 0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0730 0.6220 0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3870 1.0150 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6960 2.3590 -0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6960 3.3110 -0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3760 2.9310 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3930 3.8690 -0.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4080 0.0550 -0.0860 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1670 -1.1750 -0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0980 -1.4210 -1.1000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2260 -2.2430 -0.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7020 -3.5340 -1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7780 -4.6190 -1.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1240 -4.8750 0.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6480 -3.5840 1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5730 -2.4990 0.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 1.9260 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 -0.5230 1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 -1.7230 1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1350 3.1850 0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8340 -0.4230 0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7220 2.6600 -0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9430 4.3540 -0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2070 4.2330 0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2880 0.2750 0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1190 -1.9140 -1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8100 -3.8630 -0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4550 -3.3520 -2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4040 -5.5380 -1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6700 -4.2900 -1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2320 -5.2040 0.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8900 -5.6470 0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8950 -3.7660 2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5410 -3.2550 0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9460 -1.5800 1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6800 -2.8280 1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 M END