PUBCHEM-ZINC05716228 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 28 0 0 0 0 0 0 0 0999 V2000 4.3940 -0.2440 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5040 -1.2770 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 -0.7330 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 0.6010 0.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5830 0.9880 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0540 2.2820 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1900 3.3110 -0.0110 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6280 4.5210 0.0880 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0700 4.7720 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4380 5.5750 -1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4860 7.1230 -1.1800 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7770 6.5270 -1.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6780 5.6280 0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 -1.5200 0.0500 N 0 3 0 0 0 0 0 0 0 0 0 0 1.0150 -2.8360 0.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 -0.9030 0.0610 O 0 5 0 0 0 0 0 0 0 0 0 0 5.4720 -0.3140 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7500 -2.3290 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1170 2.4700 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3490 5.3370 0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6040 3.8210 0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5040 5.8020 -1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 4.9950 -2.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1020 7.3760 -0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5060 5.9570 -1.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 5.2310 0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9080 6.2100 1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 17 1 0 0 0 0 2 3 2 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 14 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 12 25 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END