PUBCHEM-ZINC05996518 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 32 0 0 1 0 0 0 0 0999 V2000 0.1980 0.9860 0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1320 1.0740 1.1860 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1530 0.0620 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6070 1.0580 2.6670 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0480 0.5010 2.6780 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0980 -0.5190 2.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9890 1.4390 1.9130 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0550 2.4200 2.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4800 1.5930 0.4680 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0020 2.0820 0.3860 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9690 3.0440 0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6720 2.0790 -0.8980 O 0 5 0 0 0 0 0 0 0 0 0 0 -5.3150 2.5440 -0.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7310 2.8020 -0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3190 0.9120 1.8700 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7570 1.4180 1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4630 -0.5450 4.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 0.2650 3.3950 O 0 5 0 0 0 0 0 0 0 0 0 0 0.1030 -0.1020 0.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 1.2580 0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 1.4490 -0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6810 2.1140 2.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6180 0.6370 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4500 -0.6450 5.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2740 -1.5140 4.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4170 -0.1230 4.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6970 1.4990 1.2650 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4400 1.1180 2.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 2.5200 1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3810 0.3840 4.1380 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.4510 0.0560 4.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5070 1.3140 4.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 2 27 1 0 0 0 0 4 5 1 0 0 0 0 4 18 1 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 30 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 15 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 17 24 1 0 0 0 0 17 25 1 0 0 0 0 17 26 1 0 0 0 0 17 30 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 M CHG 1 12 -1 M CHG 1 18 -1 M CHG 1 27 1 M CHG 1 30 1 M END