PUBCHEM-ZINC06485359 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 1 0 0 0 0 0999 V2000 0.9110 2.0120 0.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 0.3050 0.5370 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 -0.4480 1.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9910 -1.9430 2.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8690 -2.6540 3.0370 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9380 -2.5070 2.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5280 -4.1700 2.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7010 -4.6020 3.7690 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5220 -2.2660 4.3980 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0450 -1.2360 5.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9730 -0.4310 4.6930 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4360 0.5740 5.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8450 1.0170 6.5830 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6830 0.3760 6.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 0.9110 7.3010 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 -0.1070 7.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -1.2500 6.7050 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5460 -1.0590 6.5440 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1160 -1.6810 7.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9960 2.0750 0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 2.6380 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 2.3920 1.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3560 -0.2810 1.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 0.0590 2.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -2.0930 2.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 -2.4050 1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 -2.8930 4.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3870 1.0450 5.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 0.0670 7.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1150 -4.7820 1.9690 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 28 1 0 0 0 0 13 14 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 29 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 M CHG 1 30 -1 M END