PUBCHEM-ZINC02952602 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 0 0 0 0 0999 V2000 3.5040 -6.9800 1.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1850 -5.7240 0.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8610 -5.3650 0.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 -6.2630 1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 -7.5190 1.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -7.8770 1.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8420 -9.2220 2.3040 N 0 3 0 0 0 0 0 0 0 0 0 0 4.0080 -9.5380 2.4550 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 -10.0130 2.5770 O 0 5 0 0 0 0 0 0 0 0 0 0 1.4540 -3.7640 0.2150 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 -3.4900 0.6570 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5620 -2.9260 0.5140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 -3.8810 -1.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 -4.1960 -2.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -4.2890 -3.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 -4.0640 -4.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4560 -3.7470 -3.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5120 -3.6510 -2.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -4.1560 -5.6540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -4.4580 -6.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 -3.4430 -6.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0880 -3.7530 -7.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4330 -5.0730 -7.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5630 -6.0870 -7.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -5.7820 -6.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9860 -5.4650 -8.1140 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.2930 -6.7950 -7.7190 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8420 -4.3600 -7.8580 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7390 -5.5100 -9.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3800 -6.6930 -10.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1870 -6.7280 -11.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3540 -5.5800 -12.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7140 -4.3960 -11.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9110 -4.3620 -10.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1460 -5.6170 -14.0600 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.8280 -6.6590 -14.6040 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2930 -4.6050 -14.7220 O 0 5 0 0 0 0 0 0 0 0 0 0 4.5390 -7.2610 1.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9700 -5.0220 0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 -5.9830 1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 -8.2200 1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7030 -4.3710 -1.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8130 -4.5360 -4.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3440 -3.5720 -4.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4430 -3.4000 -1.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 -2.4110 -6.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7700 -2.9630 -7.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8350 -7.1170 -7.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 -6.5740 -6.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2500 -7.5900 -9.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9050 -7.6520 -12.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8440 -3.4990 -12.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1960 -3.4390 -10.1290 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 38 1 0 0 0 0 2 3 2 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 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 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 28 2 0 0 0 0 26 29 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 50 1 0 0 0 0 31 32 1 0 0 0 0 31 51 1 0 0 0 0 32 33 2 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 33 52 1 0 0 0 0 34 53 1 0 0 0 0 35 36 2 0 0 0 0 35 37 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M CHG 1 35 1 M CHG 1 37 -1 M END