IFLAB-ZINC04070175 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 23 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3740 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -0.6840 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4190 0.0420 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 1.4230 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0880 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 3.9780 0.0120 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.6040 -0.6070 -0.0350 F 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -2.1590 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3130 -2.7480 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -2.8540 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -4.2430 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -5.0050 -0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7200 -6.3080 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5660 -6.6650 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5390 -5.1960 -0.0460 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9000 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.5580 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3070 1.9860 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 -2.3850 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5250 -7.0280 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 -7.6760 -0.0480 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 17 1 0 0 0 0 2 3 2 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 21 1 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 M END