IFLAB-ZINC05258459 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 47 0 0 1 0 0 0 0 0999 V2000 1.5490 1.6290 -1.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9010 0.2430 -1.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4180 -0.1050 0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4460 -0.7580 1.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 -2.0040 -0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6050 -2.5670 -2.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4740 -4.5010 -3.8000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4980 -3.7150 -4.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -5.5750 -4.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 -4.9360 -4.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0140 -3.7400 -4.3170 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9250 -5.6940 -4.8380 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1380 -5.0890 -5.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1430 -3.8500 -5.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3420 -3.2540 -6.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5370 -3.8900 -5.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5360 -5.1240 -5.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3400 -5.7280 -4.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3390 -7.4190 -4.0600 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.8430 -5.1190 -3.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4260 -5.0850 -2.6170 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4860 2.0800 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5960 1.5350 -2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 2.2590 -2.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 0.3380 -1.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9650 -0.2080 -2.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4130 -0.3480 0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5540 0.9770 0.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 -0.3210 2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 -1.8300 1.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4480 -0.5910 1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -2.0550 -0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6220 -2.5910 -0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -1.9320 -3.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6940 -2.5930 -2.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 -6.0620 -5.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 -6.3160 -3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 -6.6600 -4.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2110 -3.3520 -6.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3460 -2.2900 -6.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4730 -3.4220 -6.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4710 -5.6180 -5.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 -0.6060 -0.8840 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -3.9280 -2.5080 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 -4.5200 -1.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4140 -5.7070 -4.7370 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2930 -6.0890 -4.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 43 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 5 43 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 20 1 0 0 0 0 7 44 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 20 21 2 0 0 0 0 20 46 1 0 0 0 0 44 45 1 0 0 0 0 46 47 1 0 0 0 0 M END