PUBCHEM-ZINC06468875 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 33 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -0.6060 -1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -1.9940 -1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2690 -2.6100 -2.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 -1.8360 -3.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7800 -0.4400 -3.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 0.1660 -2.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4900 -2.4880 -4.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0370 -1.7400 -5.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6880 -2.3890 -6.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7360 -3.6040 -6.5360 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2330 -1.6420 -7.4540 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8510 -2.2580 -8.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9570 -3.5400 -8.6970 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5770 -3.9550 -9.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0160 -2.9770 -10.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5760 -1.4370 -9.8470 S 0 0 0 0 0 0 0 0 0 0 0 0 6.7410 -3.1550 -11.8600 N 0 3 0 0 0 0 0 0 0 0 0 0 6.9860 -4.2750 -12.2700 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0940 -2.1810 -12.5010 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 -2.5900 -0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 -3.6880 -2.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 0.1620 -3.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 1.2440 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5340 -3.5660 -4.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9940 -0.6620 -5.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1950 -0.6740 -7.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7180 -5.0010 -10.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 28 1 0 0 0 0 9 10 2 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END