PUBCHEM-ZINC05158410 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 44 0 0 1 0 0 0 0 0999 V2000 1.7330 -0.5860 1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8070 -0.8890 0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0950 -0.6760 0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4460 -1.4490 -1.2410 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3850 -1.6890 -1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6260 -2.7380 -1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -0.8610 -1.7920 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2470 -0.2310 -0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5940 -0.5670 -2.1790 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7480 -0.9400 -3.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9290 0.9260 -2.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2940 1.2060 -2.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8920 0.3930 -3.4770 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7400 2.4720 -2.4920 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0020 3.0470 -2.9780 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2950 2.5280 -3.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1140 2.9400 -1.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6780 1.5240 -1.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6180 1.3470 -0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4200 2.2940 -0.3710 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8210 4.5620 -3.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1220 5.1920 -2.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8050 -0.8800 -3.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 -2.0790 -3.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 0.2140 0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 -1.4740 1.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1530 -0.2540 2.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3960 -0.2730 1.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9080 -0.8770 -0.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7930 -3.3680 -2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7660 -3.3290 -0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 1.4740 -2.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8780 1.3490 -1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1920 3.1130 -1.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9360 3.6210 -2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7360 3.2710 -0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8620 0.8030 -1.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2320 1.2600 -2.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 -2.2970 -1.2350 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.3640 -2.7900 -1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 -2.3940 -0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4790 0.2480 0.0180 O 0 5 0 0 0 0 0 0 0 0 0 0 5.3570 4.9740 -4.3420 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.0460 0.2040 -3.5890 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 23 1 0 0 0 0 7 39 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 21 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 39 40 1 0 0 0 0 39 41 1 0 0 0 0 M CHG 1 39 1 M CHG 1 42 -1 M CHG 1 43 -1 M CHG 1 44 -1 M END