PUBCHEM-ZINC03175561 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 30 0 0 1 0 0 0 0 0999 V2000 0.9590 0.1430 0.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -0.0420 -0.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.0900 -1.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3330 -0.4270 -0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3540 -0.4800 -1.2750 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9980 -1.1010 -2.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6110 -1.1530 -0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5030 -0.3440 -0.2480 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6600 0.8620 -1.7900 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0080 1.4710 -2.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 0.9420 -3.4910 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5200 2.8770 -3.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7890 3.5520 -4.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2340 4.9810 -4.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0850 5.4920 -3.7840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9780 0.4460 0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5360 0.9200 1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 -0.7840 1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 0.9190 -1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 -2.0750 -0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 -1.1840 -2.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7930 -0.8150 -1.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 -1.4000 0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6910 0.2920 0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4350 1.3190 -1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5930 2.8180 -3.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3970 3.4620 -2.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7130 3.5790 -4.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9190 2.9570 -5.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5920 -2.4180 -0.6110 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.6760 5.4920 -5.5770 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 19 1 0 0 0 0 3 20 1 0 0 0 0 3 21 1 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 4 24 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 25 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 26 1 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 14 15 2 0 0 0 0 14 31 1 0 0 0 0 M CHG 1 30 -1 M CHG 1 31 -1 M END