IFLAB-ZINC04639478 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 0 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 0 0 0 0 0 0 0 0 0 0 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -0.8470 2.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 -1.2860 3.4230 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0080 -1.4020 3.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7470 -1.0740 2.3330 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 -1.1640 2.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1310 -0.6280 1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7780 -0.3350 0.2250 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8200 -1.9890 4.8780 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3890 -2.2500 5.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8550 -2.7680 7.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1690 -1.8860 8.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5930 -2.4070 9.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6890 -3.7780 9.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 -4.5860 8.6810 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 -4.1260 7.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 -0.7270 2.3790 C 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 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 -1.3060 6.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -2.9770 5.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0850 -0.8190 8.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8460 -1.7500 10.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0190 -4.1920 10.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7220 -4.8200 6.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 -1.6630 2.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 -0.5150 3.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7730 0.0830 1.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 3 4 2 0 0 0 0 3 9 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 12 26 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 27 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 16 17 2 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 18 30 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 M END