IBS-ZINC02233517 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 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 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0850 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7780 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0930 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6970 -1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 0.0440 -2.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 1.3480 -2.6340 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 1.6500 -3.8830 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 0.5560 -4.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -0.5030 -3.7510 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 -1.8300 -4.0750 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 0.4730 -6.3710 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 2.2380 -6.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 2.4150 -8.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 2.4810 -8.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 2.6440 -10.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 2.7410 -11.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 2.6750 -10.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 2.5180 -8.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2220 2.9630 -12.8890 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 2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6260 2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -3.8580 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6350 -2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9550 -2.1980 -4.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 -1.9860 -4.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0140 2.6940 -6.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7650 2.7170 -6.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2830 2.4050 -8.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3230 2.6950 -10.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 2.7500 -10.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9810 2.4700 -8.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 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 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 15 33 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 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 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 36 1 0 0 0 0 21 37 1 0 0 0 0 M END