IFLAB-ZINC04387967 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 33 0 0 0 0 0 0 0 0999 V2000 -0.0270 1.2990 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 1.7070 -0.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2080 1.0640 -0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4170 -0.0040 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 -0.4100 0.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 0.2430 0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7150 -0.6960 0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8540 -0.0020 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1320 -0.7080 -0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1660 -1.9220 -0.0950 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2700 -0.0150 -0.3790 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4720 -0.6930 -0.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4640 -1.9400 -1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6530 -2.6060 -1.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8510 -2.0340 -1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8620 -0.7940 -0.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6770 -0.1190 -0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1230 -2.7520 -1.2870 N 0 3 0 0 0 0 0 0 0 0 0 0 12.1140 -3.8450 -1.8240 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1790 -2.2500 -0.9460 O 0 5 0 0 0 0 0 0 0 0 0 0 4.8010 1.8840 -0.1930 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 1.8090 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 2.5310 -1.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9990 1.3830 -1.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5400 -1.2330 1.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 -0.0700 1.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7560 -1.7600 0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2550 0.9550 -0.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5290 -2.3870 -1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6470 -3.5760 -1.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7990 -0.3500 -0.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6870 0.8520 0.2530 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 24 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 21 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 28 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 18 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 32 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