IFLAB-ZINC05184629 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 -0.8320 -0.0390 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8990 0.0610 0.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6790 -2.1210 0.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3470 -1.0640 -1.6260 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6280 0.0340 -2.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4440 1.0580 -1.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7250 2.1470 -2.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1990 2.2250 -4.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3790 1.2020 -4.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1000 0.1000 -3.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8130 1.2840 -5.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 0.3920 -6.3110 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0890 2.3470 -6.6760 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5570 2.4240 -7.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 3.3990 -8.7870 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1740 3.3090 -9.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4440 2.2050 -10.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5480 1.2420 -8.6710 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3930 -1.9620 -1.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8580 1.0030 -0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3590 2.9390 -2.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4210 3.0770 -4.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4700 -0.6960 -4.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6580 3.0580 -6.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2780 4.0670 -10.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8900 1.9460 -11.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 M END