PUBCHEM-ZINC04530273 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 40 0 0 1 0 0 0 0 0999 V2000 -0.9890 1.8760 1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 0.1500 0.6870 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2570 -0.5190 0.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2200 -1.9900 0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6100 -2.6470 0.1540 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0720 -2.5720 1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3590 -4.1480 -0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6120 -4.4420 -1.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5120 -2.0310 -0.8320 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3400 -0.9630 -0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4420 -0.4190 0.5240 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1570 -0.4970 -1.7840 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.4940 -1.3850 -2.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3140 0.4200 -2.6840 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.3830 -0.0900 -2.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0780 0.8440 -3.9630 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.9630 1.4260 -3.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1970 1.7360 -4.8540 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.3220 1.1810 -5.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9590 2.2880 -6.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1200 3.2690 -6.6770 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5930 3.5750 -7.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7000 2.8570 -4.0950 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4300 3.4980 -4.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5040 -0.2880 -4.7170 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3110 -0.6350 -4.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9680 1.5990 -1.9340 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6950 2.2810 -2.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3190 0.2100 -1.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 2.4570 1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5570 2.2950 0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5730 1.9560 1.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7490 -0.4070 1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7950 0.0730 -0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7750 -2.0760 -0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5620 -2.5420 0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4910 -2.5090 -1.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1980 1.5040 -6.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8780 2.7960 -5.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9660 0.9160 -0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9530 -4.8740 0.7590 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 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 41 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 29 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 27 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 25 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 23 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 29 40 1 0 0 0 0 M CHG 1 41 -1 M END