IFLAB-ZINC04342274 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 32 0 0 0 0 0 0 0 0999 V2000 2.1360 1.4030 0.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1480 0.0220 0.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -0.6810 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 -0.0030 -0.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 1.3780 -0.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 2.0860 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 3.4840 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 4.1870 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 5.5990 0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 6.3440 0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 7.7020 0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 8.3550 0.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6210 7.6580 0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5930 6.2620 0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7160 5.5280 0.2940 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6550 4.2220 0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5130 3.5590 0.0990 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 8.4910 0.3780 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.1050 7.9280 0.2960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 9.7040 0.4780 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2250 -2.5720 0.0300 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.8700 1.9510 1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -0.5100 1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 -0.5540 -1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 1.9070 -1.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 3.9600 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 5.8480 0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4730 9.4310 0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5640 8.1790 0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5790 3.6620 0.1710 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 17 2 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 12 13 2 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END