PUBCHEM-ZINC05353389 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 30 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 -0.4650 -1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 -0.0840 -1.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4920 0.6210 -0.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6770 -0.5030 -2.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9690 -0.1200 -2.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6920 -0.5400 -3.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0040 -0.2270 -4.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3020 -0.8540 -5.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1870 -1.5100 -5.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2240 -1.3230 -4.7770 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0540 -2.3090 -6.9290 N 0 3 0 0 0 0 0 0 0 0 0 0 6.0000 -2.4150 -7.6890 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9990 -2.8600 -7.1880 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -1.6240 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2010 -1.1290 -3.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4450 0.5050 -1.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6710 0.3810 -3.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2450 -0.8190 -5.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 21 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 24 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 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 2 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END