PUBCHEM-ZINC05592406 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.4750 1.5620 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 0.0700 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 -0.6370 1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -2.0240 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -2.7240 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 -2.0160 -1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 -0.6290 -1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 -4.2230 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 -4.7990 -0.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1950 -6.1620 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4950 -6.6670 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7280 -8.0470 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6600 -8.9550 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3570 -8.4300 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 -7.0500 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8340 -10.4210 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 -11.2750 -0.0670 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 -12.5890 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6580 -12.6980 0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3830 -11.1600 0.1400 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.4140 -13.9420 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7650 -15.0350 0.0820 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.2680 -13.6680 -0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 2.0360 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 1.9030 -0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0090 1.8980 0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 -0.1130 2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -2.5560 2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 -2.5410 -2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3350 -0.0980 -2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -4.5270 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -4.5340 0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3400 -5.9830 0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7620 -8.3820 0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 -9.1040 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 -6.7140 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 -14.2960 0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4350 -14.2930 -1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -13.2450 -0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6800 -13.8620 0.2360 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 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 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 40 2 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 M CHG 1 22 -1 M END