IFLAB-ZINC05258448 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 36 0 0 1 0 0 0 0 0999 V2000 -0.0260 1.5210 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -0.0090 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4460 -0.5360 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7940 -2.5460 0.0110 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4430 -1.8950 -0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7870 -3.9460 -0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3940 -3.8530 -2.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1450 -2.7730 -2.5510 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3200 -4.9700 -2.8090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 -4.8740 -4.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3970 -3.7130 -4.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1480 -3.6220 -6.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5740 -4.6850 -6.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2470 -5.8420 -6.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4870 -5.9380 -4.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 -7.5190 -3.9270 Br 0 0 0 0 0 0 0 0 0 0 0 0 -3.3040 -2.6240 1.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6020 -2.2650 2.3430 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9970 1.8960 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8830 -0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 1.8740 0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 -0.3620 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 -0.3710 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9620 -0.1830 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9650 -0.1730 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 -4.5740 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7820 -4.3840 -0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4410 -5.8400 -2.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8460 -2.8830 -4.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4030 -2.7190 -6.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 -4.6100 -7.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7990 -6.6710 -6.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 -2.0040 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9000 -2.3560 -0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5380 -3.0930 1.6710 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8210 -3.1240 2.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 17 1 0 0 0 0 4 33 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 33 34 1 0 0 0 0 35 36 1 0 0 0 0 M END