IBS-ZINC01825426 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7020 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.8180 -2.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -4.2750 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6370 -4.9030 -0.0070 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.3220 -6.6370 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 -7.2150 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 -8.4930 -0.0400 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5500 -8.8090 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2590 -7.6300 -0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6170 -7.4840 0.0110 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1170 -10.1750 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3050 -11.2700 0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8390 -12.5420 0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1760 -12.7340 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9870 -11.6520 -0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4660 -10.3740 -0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8130 -11.9260 -0.7360 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 -3.0120 -2.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 -2.2170 -3.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -3.7630 -2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -4.6260 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -4.6360 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9910 -7.4410 -0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0520 -8.2240 0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 -11.1230 0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2110 -13.3900 0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5890 -13.7320 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1000 -9.5300 -0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 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 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 29 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 40 1 0 0 0 0 M END