PUBCHEM-ZINC05125482 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 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 0.0290 -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 3.8910 2.3120 -0.0240 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6010 3.5890 0.5290 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8800 1.4420 0.5080 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3240 2.5870 -1.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8810 3.7240 -2.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2190 3.9420 -3.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0050 3.0190 -4.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4480 1.8790 -3.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1120 1.6680 -2.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2860 0.8920 -4.4190 N 0 3 0 0 0 0 0 0 0 0 0 0 6.6750 -0.1090 -3.8440 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5860 1.0800 -5.5840 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2280 -2.1590 -0.0200 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1820 -2.7820 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 -2.7530 -0.0340 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9060 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 3.3380 -0.4980 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1660 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2690 4.4430 -1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8720 4.8300 -4.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4610 0.7840 -1.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3380 3.2300 -5.6560 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1620 3.7230 -5.7760 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 19 1 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 7 1 0 0 0 0 6 25 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 15 2 0 0 0 0 11 12 2 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 28 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 29 30 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M CHG 1 19 1 M CHG 1 21 -1 M END