IBS-ZINC04733878 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 40 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.8010 1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -0.4970 2.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -1.5100 3.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -2.8370 3.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -3.1590 1.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.1450 0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.1370 -0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.7820 -1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.4980 -2.4280 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -1.4900 -3.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -2.7590 -2.9180 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -3.0810 -1.6700 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 -1.1960 -4.6620 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -2.2330 -5.6040 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -1.9570 -6.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -3.0490 -7.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 -2.7560 -9.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 -3.7820 -10.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 -5.0990 -9.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -5.3960 -8.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -4.3800 -7.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -6.4990 -10.9980 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 0.5340 2.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -1.2670 4.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -3.6220 3.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -4.1940 1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -0.2720 -4.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -0.9290 -7.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 -1.7290 -9.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 -3.5570 -11.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 -6.4260 -8.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -4.6130 -6.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 10 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 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 30 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 9 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 M END