IFLAB-ZINC05250783 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 33 0 0 0 0 0 0 0 0999 V2000 -0.0130 1.3780 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -0.0060 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -0.5480 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4400 0.7260 -0.0270 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 1.9600 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 -2.0260 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5930 -2.5000 -1.4060 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8470 -3.7990 -1.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0160 -4.5760 -0.7450 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9200 -4.2830 -3.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7510 -3.5060 -3.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1740 -5.5820 -3.3280 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1470 -6.0530 -4.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5820 -5.2410 -5.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5540 -5.7110 -6.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0940 -6.9880 -7.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6600 -7.7990 -6.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6910 -7.3380 -4.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0640 -7.4880 -8.6400 N 0 3 0 0 0 0 0 0 0 0 0 0 2.4460 -6.7740 -9.5510 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6600 -8.6120 -8.8750 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9330 1.9440 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 -0.6020 0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 3.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4730 -2.2110 0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 -2.5580 0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 -1.8800 -2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 -6.1890 -2.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9410 -4.2440 -5.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8910 -5.0800 -7.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 -8.7950 -6.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 -7.9730 -4.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 10 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 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 32 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END