NCID-ZINC01593471 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.4630 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 -0.0620 -0.0660 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1220 -0.4220 -0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 -0.5230 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 -0.8870 1.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2220 -0.5330 2.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5570 -0.1590 2.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2140 -0.1960 3.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5560 -0.6050 4.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2580 -0.6230 6.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 -1.0240 7.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2830 -1.4240 7.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 -1.8370 8.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7110 -2.2290 8.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4300 -2.2200 7.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8090 -1.8180 6.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -1.4110 6.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1970 -0.9950 4.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 -0.9440 3.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7370 -0.9920 8.9310 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 -2.1720 -1.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5330 -0.0110 -2.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 1.8110 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 1.8580 -0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 1.9190 0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1280 0.1710 1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2620 0.1040 3.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3040 -0.3210 6.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 -1.8610 9.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1830 -2.5390 9.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4740 -2.5230 7.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4300 -1.8330 5.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4850 -1.2300 3.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 -2.2960 -1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -2.6560 -0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 -2.5830 -2.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 0.9830 -2.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 0.0420 -2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -0.5930 -3.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 -0.6940 -1.2470 N 0 3 0 0 0 0 0 0 0 0 0 0 1.6770 -0.6300 -0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 40 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 19 2 0 0 0 0 7 8 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 2 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 33 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 21 40 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 40 1 M END