IBS-ZINC06661938 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 0.0080 1.4130 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -0.0160 0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1850 -0.6440 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3540 0.1020 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5820 -0.5330 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -1.9180 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4740 -2.6700 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -2.0290 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5370 -4.0690 0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6180 -4.7770 -0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 -4.2070 -1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7400 -6.2340 -0.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8830 -7.0690 -1.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 -8.3700 -1.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5030 -8.2760 -0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7140 -6.9880 -0.2250 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5930 -9.7250 0.0130 Br 0 0 0 0 0 0 0 0 0 0 0 0 -4.8940 -2.5610 0.0480 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6640 -2.2080 1.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9880 -2.9760 1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7000 -2.6830 0.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9790 -3.0160 -1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6550 -2.2470 -1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 1.7850 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 1.7820 -0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 1.7610 0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3050 1.1800 0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4910 0.0500 0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3330 -2.6090 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2420 -4.5280 0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -6.7820 -1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9440 -9.2770 -1.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0920 -2.4720 2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8650 -1.1360 1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7880 -4.0460 1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5870 -2.6740 2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7790 -4.0870 -1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5720 -2.7420 -2.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8560 -1.1770 -1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0770 -2.5410 -2.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 18 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 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 20 36 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 M END