NCID-ZINC05732914 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.6370 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 0.1060 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5900 -0.5340 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -1.9320 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 -2.6800 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2500 -2.0300 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 -2.7510 -0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 -4.1750 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9700 -2.5840 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0180 -1.9140 -0.3130 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9430 -0.5210 -0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8810 0.2430 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0990 -4.0260 0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5450 -4.4440 0.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9980 -5.1640 -0.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3260 -5.5500 -0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2030 -5.2110 0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7440 -4.4890 1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4140 -4.1120 1.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7870 -3.1340 2.8910 Br 0 0 0 0 0 0 0 0 0 0 0 0 -10.5080 -5.5870 0.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.3500 -5.2040 1.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7730 -6.2580 -1.8580 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8170 -6.5700 -2.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3300 1.1860 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5130 -3.7590 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 -4.4830 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 -4.6270 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 -4.5000 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6950 -0.4860 -1.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9130 -0.0480 -0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2150 0.3730 1.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7220 1.2200 -0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5040 -4.6510 -0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7410 -4.1420 1.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3150 -5.4260 -1.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4220 -4.2250 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3630 -5.5660 1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9680 -5.6370 2.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3630 -4.1180 1.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3030 -7.1350 -3.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4070 -5.6460 -3.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0120 -7.1660 -2.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 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 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 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 41 1 0 0 0 0 18 19 1 0 0 0 0 18 25 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 M END