IFLAB-ZINC04101869 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -1.4850 1.9720 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1440 0.5070 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8030 -0.1940 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 -1.5380 1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 -2.1810 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 -1.4790 -1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1790 -0.1360 -1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 -3.8940 -0.1890 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 -4.1260 -1.5260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6890 -4.1870 0.9420 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5290 -4.7390 0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6000 -4.6240 -0.9800 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1750 -4.3380 -1.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6020 -3.5600 -0.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3140 -5.9700 -1.1180 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8220 -6.2100 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3050 -7.0440 -1.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8790 -7.9730 -0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 -8.8580 -1.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 -8.6480 -2.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5140 -7.2700 -2.9860 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7920 -5.0820 -3.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8120 -5.0910 -4.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6030 -5.3760 -2.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5820 -5.3660 -1.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0800 -4.4870 -5.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 2.5650 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 2.2280 -0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9240 2.1840 1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7800 0.3080 2.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2220 -2.0860 2.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -1.9810 -2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 0.4110 -2.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6450 -5.3110 0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0630 -2.6800 -0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2410 -3.2830 -1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2150 -3.9580 0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2340 -8.0310 0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 -9.6580 -0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -9.2360 -2.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8490 -5.4980 -3.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6330 -4.0570 -2.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4510 -4.4660 -5.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9500 -6.1120 -4.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7610 -6.4000 -3.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5460 -4.9600 -2.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4440 -4.3460 -1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9440 -5.9910 -0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2460 -5.4820 -5.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7070 -3.8270 -5.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0200 -4.0950 -4.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3000 -5.8930 -2.2040 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0950 -4.5650 -3.9710 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 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 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 52 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 22 52 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 24 53 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 52 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 53 1 0 0 0 0 M END