IFLAB-ZINC04033463 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1500 -0.7890 -1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9480 -0.7030 -2.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9580 -1.0690 -3.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1740 -1.5230 -2.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3910 -1.6140 -1.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3820 -1.2480 -0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2930 -1.2280 0.7590 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1160 -0.8010 1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6470 -0.6480 2.5380 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6200 -0.2830 2.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 -1.9790 3.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 -1.5570 4.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1550 -2.2620 5.6880 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6480 -0.2870 4.6860 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5900 0.2810 3.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1030 0.4050 5.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2120 1.1400 6.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6640 1.8220 7.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0020 1.7740 8.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8920 1.0430 7.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4480 0.3640 6.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6660 -0.6290 5.1100 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0040 -0.3500 -2.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8020 -1.0020 -4.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9570 -1.8060 -3.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3420 -1.9670 -1.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5510 -2.6080 2.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8310 -2.5030 3.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1840 1.2920 3.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5830 0.2860 2.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1670 1.1780 6.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9720 2.3940 8.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3530 2.3080 8.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9360 1.0070 7.5540 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 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 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 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 M END