IFLAB-ZINC04107785 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 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 3 0 0 0 0 0 0 0 0 0 0.4970 -0.3830 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 -0.5580 1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -1.8520 1.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -2.0640 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9680 -3.2320 1.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0910 -3.4220 1.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3830 -4.1400 2.3370 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1260 -3.8960 2.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -2.8040 2.4950 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6390 -5.0830 3.8580 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 -4.2640 4.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0730 -5.1220 5.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6470 -6.1830 5.4620 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3050 -4.7100 5.4170 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1300 -5.5440 6.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4500 -4.8610 6.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5930 -3.9980 7.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8040 -3.3720 7.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8740 -3.6100 6.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7310 -4.4750 5.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5200 -5.1040 5.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0590 -2.9980 7.2160 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.0890 -5.3680 2.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6910 -0.6890 0.1610 S 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 1.7220 -0.7360 1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 0.1710 2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7410 -4.1160 3.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0530 -3.2980 4.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6460 -3.8610 5.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6140 -5.6920 7.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3030 -6.5100 5.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7570 -3.8120 8.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9140 -2.6970 8.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5660 -4.6610 5.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4090 -5.7820 4.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0720 -5.3780 2.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 -6.2320 2.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2040 -5.4070 3.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 26 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 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 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 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 39 1 0 0 0 0 23 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 M END