NCID-ZINC04715455 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 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 -1.1980 -0.6360 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2490 -2.0260 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4600 -2.6700 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6460 -1.9260 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5890 -0.5270 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 0.1080 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9450 -2.6100 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9920 -3.8220 0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2200 -1.8070 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4030 -2.7410 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2270 -3.9420 0.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7600 -2.2010 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8680 -3.0690 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1480 -2.5490 0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3440 -1.1740 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2570 -0.3080 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9690 -0.8090 0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9090 0.0380 0.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.5420 1.5620 0.1090 Br 0 0 0 0 0 0 0 0 0 0 0 0 -12.6050 -0.6730 0.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.6780 -1.6160 0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6800 -4.4120 0.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.8500 -5.2320 0.0750 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 -0.3340 -2.5990 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4980 -3.7490 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5010 0.0520 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3280 1.1860 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2450 -1.1840 0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2620 -1.1730 -0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9990 -3.2140 0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6090 0.2920 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6300 -1.0850 0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6200 -2.2370 -0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6040 -2.2470 1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5590 -6.2820 0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4340 -5.0250 0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4510 -5.0140 -0.8080 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 9 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 20 36 1 0 0 0 0 22 23 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 M END