PUBCHEM-ZINC04666686 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 0 0 0 0 0 0999 V2000 0.1070 1.3890 0.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 0.0250 0.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 -0.6200 -0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 0.0850 -0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4260 1.4510 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 2.1070 0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9300 2.3510 -0.2640 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6560 3.7620 -0.0930 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9640 1.6690 0.4810 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2390 2.1000 -1.9010 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4820 2.8200 -2.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1530 4.1550 -3.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 -2.0470 -0.4620 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1180 -2.6650 -0.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1400 -2.5440 -1.0190 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.7800 1.8930 1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8770 -0.5130 0.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2980 -0.4100 -0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 3.1670 0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0740 1.5600 -2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4320 2.1870 -3.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 2.9820 -2.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2160 4.8200 -2.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1600 4.0060 -3.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3790 4.8880 -4.3020 N 0 3 0 0 0 0 0 0 0 0 0 0 3.8260 5.7900 -4.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4220 5.0970 -3.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3120 4.3630 -5.1850 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 16 1 0 0 0 0 2 3 2 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 4 5 2 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 19 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 20 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 11 22 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 12 25 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M CHG 1 25 1 M END