PUBCHEM-ZINC04566075 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 1 0 0 0 0 0999 V2000 1.0950 4.0300 1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 3.0480 2.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 1.7860 2.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 1.4940 1.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8520 2.4880 0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2630 3.7490 0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9100 0.1110 1.5160 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5640 -0.3350 2.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 -0.7370 0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0110 -0.6550 -0.7790 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3960 0.1850 1.5510 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1000 -0.8880 1.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6130 -2.2410 1.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6570 -3.1740 0.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1990 -4.4710 1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7310 -4.8400 2.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7180 -3.8950 3.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1560 -2.5960 3.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2180 -5.4640 0.0590 N 0 3 0 0 0 0 0 0 0 0 0 0 4.9190 -5.2250 -0.9350 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5550 -6.4990 0.2190 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6350 5.0100 1.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 3.2600 2.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 1.0210 2.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7550 2.2680 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7130 4.5080 -0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1970 -0.7930 1.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0020 -2.8730 -0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3740 -5.8470 2.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3560 -4.1680 4.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -1.4710 0.5960 O 0 5 0 0 0 0 0 0 0 0 0 0 4.1160 -1.7200 4.2390 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2460 -0.8130 3.9050 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 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 24 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 25 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 27 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 28 1 0 0 0 0 15 16 1 0 0 0 0 15 19 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 17 30 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 32 33 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M CHG 1 31 -1 M END