PUBCHEM-ZINC00208561 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 0 0 0 0 0 0999 V2000 -0.4450 2.6730 2.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 1.8870 1.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 0.6730 2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 -0.4940 2.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0860 -1.4730 2.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 -1.0670 3.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5710 0.5990 2.5730 S 0 0 0 0 0 0 0 0 0 0 0 0 3.3760 -1.8590 3.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6560 -1.8770 3.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1250 -1.3810 1.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4060 -1.6290 1.7980 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8410 -2.1610 2.7850 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9090 -2.3890 3.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0660 -2.9040 4.8230 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3100 -0.7390 0.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5620 0.5790 0.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 1.1710 -0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 0.4590 -1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5320 -0.8500 -0.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2910 -1.4540 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0960 -0.7100 1.8880 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6220 -1.7880 2.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7360 0.1910 1.3760 O 0 5 0 0 0 0 0 0 0 0 0 0 0.2530 2.9880 3.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9080 3.5510 2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2160 2.0400 2.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 1.5720 0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0790 2.5200 0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -2.4610 3.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1510 -2.4540 4.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3520 1.1370 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9950 2.1930 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1940 0.9260 -1.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 -1.4020 -1.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0940 -2.4780 0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 2 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 2 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END