IFLAB-ZINC02947651 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3800 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 -0.6860 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0120 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 1.4080 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 2.0890 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6560 2.1620 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7160 1.5660 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6400 3.5100 -0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8350 4.2180 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0160 3.6820 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0460 4.5080 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7200 5.8020 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9630 5.9230 -0.0200 S 0 0 0 0 0 0 0 0 0 0 0 0 7.6870 6.9580 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9960 7.3500 -1.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2190 8.2990 -2.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5020 8.6600 -3.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5640 8.0720 -4.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3410 7.1220 -3.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0600 6.7660 -2.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8410 8.4240 -5.3390 F 0 0 0 0 0 0 0 0 0 0 0 0 4.0420 -0.9220 -0.0410 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5540 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -1.7660 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 3.1690 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7950 3.9850 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0690 4.1630 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2420 7.8040 0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6080 6.6630 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3910 8.7570 -1.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8950 9.4000 -3.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1700 6.6630 -3.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6690 6.0280 -1.6160 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 7 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 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 M END