IBS-ZINC04940501 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 42 0 0 1 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 0.6260 -0.6190 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 0.1450 2.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8450 -0.4610 3.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9100 -1.8490 3.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 -2.6230 2.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6750 -1.9970 1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5620 -4.0210 2.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2440 -4.0140 3.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4620 -2.7260 4.0910 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9340 -2.4670 4.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 -5.2370 1.7550 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1540 -5.0650 1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 -5.6120 0.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6230 -7.0000 1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9830 -7.3670 2.1520 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -6.4190 2.6300 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6330 -7.8080 0.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9640 -9.0830 0.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9100 -9.8330 0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5300 -9.3270 -0.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2070 -8.0640 -1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2580 -7.3050 -0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8250 -10.3630 -1.8490 Br 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 1.1610 1.2230 2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 0.1410 3.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 -2.5880 0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5730 -4.8950 4.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7300 -5.6270 -0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0170 -4.9170 0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 -6.5210 3.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4810 -9.4790 1.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1670 -10.8190 0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6950 -7.6740 -2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0040 -6.3230 -1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 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 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 18 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 M END