IFLAB-ZINC00888939 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 0 0 0 0 0999 V2000 0.0180 1.4850 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 0.0200 0.0450 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -0.7210 1.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -0.7980 -1.3940 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 -2.0880 -1.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 0.0850 -2.3520 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6930 -1.0400 -1.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 -2.1790 -1.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6810 -2.3740 -1.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3300 -1.4220 -2.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6430 -0.2760 -3.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3280 -0.0950 -2.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7370 -1.6250 -3.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3330 -2.6230 -2.6770 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3610 -0.7030 -3.7920 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7200 -0.8360 -4.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5500 -1.5520 -3.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9130 -1.7030 -3.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4750 -1.1390 -4.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6540 -0.4150 -5.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2760 -0.2470 -5.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5450 0.4970 -6.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1960 1.0180 -7.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5650 0.8350 -7.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3060 0.1260 -6.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7600 -0.2660 -6.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8720 -1.1000 -5.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 1.8580 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 1.8500 -0.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 1.8380 0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 -0.9140 1.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 -1.6680 1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 -0.1320 2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8650 -2.9150 -0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2070 -3.2630 -1.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1390 0.4650 -3.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7940 0.7890 -2.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8640 0.0530 -4.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1300 -2.0090 -2.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5270 -2.2700 -2.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4840 0.6560 -6.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6330 1.5910 -7.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0400 1.2640 -8.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0480 -0.8660 -7.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3870 0.6230 -6.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5540 -0.6200 -4.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2140 -2.1090 -5.3970 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 1 0 0 0 0 2 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 6 2 0 0 0 0 4 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 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 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 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 27 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 M END