PUBCHEM-ZINC00326689 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 0 0 0 0 0 0999 V2000 0.2060 1.5960 -0.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 0.1460 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -0.0340 1.2180 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 0.2850 2.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8090 -0.8780 2.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 -1.8750 2.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5380 -0.8090 4.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3380 -1.8810 4.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0770 -1.9190 5.4540 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7750 -3.0200 5.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6190 -3.9580 4.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4970 -3.3400 3.5120 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 -0.4940 1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6060 -0.6890 0.1980 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6770 -0.7630 2.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0210 -1.5000 3.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6480 -1.7460 4.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9250 -1.2650 4.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5810 -0.5340 3.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9670 -0.2860 2.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5920 -1.5340 6.2470 N 0 3 0 0 0 0 0 0 0 0 0 0 4.0160 -2.1770 7.1070 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7160 -1.1110 6.4520 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2640 1.8290 -0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 1.7310 -1.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 2.2630 0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 -0.0870 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 -0.5200 -0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 0.4790 3.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 1.1700 2.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5050 -0.0120 4.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4200 -3.1510 6.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1000 -4.9250 4.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -1.8750 3.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1410 -2.3160 5.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5770 -0.1610 4.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4830 0.2810 2.0060 H 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 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END