IFLAB-ZINC02696206 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 0 0 0 0 0 0999 V2000 0.2110 1.1300 0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 -0.2750 0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 -0.7670 -1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 0.0130 -2.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.5760 -3.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1950 -1.9470 -3.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4290 -2.7360 -2.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 -2.1560 -1.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7060 -2.8940 -0.2710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 -4.1830 -0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 -5.2030 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7030 -6.5250 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 -6.8080 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 -5.7910 -0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 -4.4700 -0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 -8.5270 0.0780 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4100 -8.5290 -0.7620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 -9.2620 -0.4780 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 -8.8070 1.6190 N 0 5 0 0 0 0 0 0 0 0 0 0 -2.2550 -8.2090 1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3150 1.3460 1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 1.6720 -0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7810 1.4720 -0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1150 1.0860 -2.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 0.0390 -4.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -2.4020 -4.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -3.8000 -2.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1930 -4.9690 0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 -7.3250 0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6370 -6.0230 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8560 -3.6730 -0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 2 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 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 31 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 M CHG 1 19 -1 M END