CHEMSTAR-ZINC04122585 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 0 0 0 0 0 0999 V2000 0.0750 -2.9920 2.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -2.1260 1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -0.7510 1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 0.0410 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -0.5820 -1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -1.9710 -1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -2.6920 -0.0930 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -2.6110 -2.4420 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -3.9520 -2.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 -4.8810 -1.0700 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 -4.5620 -3.7060 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 -5.9020 -3.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 -6.5620 -2.7520 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4590 -6.5710 -5.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5820 -7.9590 -5.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 -8.5810 -6.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -7.8260 -7.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5380 -6.4460 -7.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -5.8160 -6.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 -5.7110 -8.6320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -6.4260 -9.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 -9.9330 -6.4600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9030 -10.5080 -7.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 0.0450 2.9450 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 -3.2120 2.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 -3.9230 2.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -2.4650 3.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 1.1180 0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 0.0030 -2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 -2.0920 -3.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 -4.0350 -4.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 -8.5470 -4.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -8.3140 -8.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -4.7420 -6.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -5.7220 -10.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 -6.9730 -9.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 -7.1280 -9.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -10.2640 -8.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 -10.1090 -8.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9940 -11.5910 -7.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 30 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 31 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 22 1 0 0 0 0 17 18 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 M END