IFLAB-ZINC01772111 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 0 0 0 0 0 0999 V2000 2.5800 -5.5600 -2.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6770 -4.5710 -1.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 -5.0960 -1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 -4.1070 -0.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0780 -4.6240 -0.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3390 -5.6810 -1.1240 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0550 -3.9130 0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3830 -4.3440 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6760 -5.7020 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9880 -6.1240 -0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0110 -5.1970 -0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7230 -3.8440 -0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4130 -3.4160 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6840 -5.7400 -0.3290 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.4130 -4.6820 -0.9380 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6470 -7.0600 -0.8520 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2520 -5.8670 1.2220 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.3730 -4.7340 2.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8500 -4.8290 3.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9520 -3.6640 4.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5940 -2.5080 3.5150 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.1480 -2.4570 2.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0300 -3.5390 1.5340 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.4110 -3.7060 5.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.4860 -2.4640 6.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6040 -5.1860 -2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5480 -6.5270 -1.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2320 -5.6730 -3.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0250 -4.4580 -0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7090 -3.6040 -1.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -5.2090 -2.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 -6.0630 -0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 -3.9940 0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6310 -3.1400 -1.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8360 -3.1030 0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8780 -6.4270 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2170 -7.1800 -0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5240 -3.1220 -0.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1890 -2.3590 -0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5010 -6.7340 1.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1330 -5.7840 3.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8660 -1.5020 1.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8680 -2.6390 7.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4930 -2.0200 6.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1560 -1.7860 5.5130 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 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 40 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 41 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 24 25 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 M END