IFLAB-ZINC04139224 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.1050 1.7400 -0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 0.2430 -0.1510 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5200 0.0790 0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.4990 -1.3140 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0870 -0.2580 -2.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 -1.9840 -1.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 -2.8300 -1.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 -4.1520 -1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -4.3800 -0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5110 -2.8680 0.0950 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6040 0.1120 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0820 0.4800 -0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1950 1.6440 -1.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6300 1.4850 -2.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1470 1.1270 -2.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 -0.2610 0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0150 -0.1610 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4220 0.3460 2.1710 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4050 -0.6750 1.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9980 -1.1830 0.5030 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0010 -0.5760 2.6380 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3630 -1.0800 2.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7920 -0.8490 4.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4280 0.3290 4.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8210 0.5410 5.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5800 -0.4250 6.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9440 -1.6040 6.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5560 -1.8170 5.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0740 -0.1590 8.5100 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.8910 2.1680 -0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 1.8870 -1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7960 2.2320 0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 -2.5070 -2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 -4.9390 -1.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 -5.3460 0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5160 -0.8080 0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 0.9170 0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5100 0.6850 0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6160 -0.3480 -0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7310 2.4160 -2.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1510 0.6860 -2.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6160 1.9490 -1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7260 0.9490 -3.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 -0.6660 -0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5270 -0.1700 3.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0410 -0.5540 2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3890 -2.1470 2.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6160 1.0830 3.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3170 1.4610 6.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7560 -2.3580 7.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0640 -2.7380 4.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0130 -0.0880 -1.4190 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 52 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 11 52 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 15 52 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 M END