IFLAB-ZINC04338958 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 0.9420 0.9820 0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 -0.5040 0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 -1.0880 1.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 -2.5350 1.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9050 -3.6450 2.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 -4.9140 1.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -5.0870 0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2270 -3.9990 -0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 -2.7130 0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 -1.4580 -0.3420 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -1.2790 -1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -5.9980 2.7480 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 -7.2820 2.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -0.3880 3.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 -0.2110 3.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9730 0.4690 4.7290 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2360 0.7390 5.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3970 1.3780 6.4080 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9170 1.7310 6.9610 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.6700 0.5300 6.8620 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7460 2.4420 8.1790 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6370 2.8650 5.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4590 2.4010 4.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0240 3.2900 3.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7660 4.6440 4.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9450 5.1080 5.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3840 4.2190 5.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9540 1.3830 0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 1.1760 -0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3200 1.4610 1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7800 -3.5120 3.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -6.0830 0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3530 -4.1450 -1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0430 -8.0580 2.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 -7.4210 1.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 -7.3460 1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 -0.9850 3.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 0.5890 3.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 0.3860 2.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2820 -1.1890 3.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 0.7300 5.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6200 1.6210 6.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6600 1.3440 4.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6660 2.9280 3.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2070 5.3390 3.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7440 6.1650 5.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7450 4.5820 6.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2800 0.3890 4.5040 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1700 0.4990 4.8750 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 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 14 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 48 2 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 48 49 1 0 0 0 0 M END