PUBCHEM-ZINC04523462 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 24 0 0 1 0 0 0 0 0999 V2000 -0.3170 1.4430 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.0390 0.1300 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9230 -0.6020 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 -0.1710 1.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0770 -0.6790 1.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 -0.6020 -1.0860 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -0.7610 -2.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.4890 -2.4940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 -1.2560 -3.4470 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9020 -0.9440 -3.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7650 -2.7720 -3.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 -3.2190 -4.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2270 -2.3150 -5.8800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 2.0200 -0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9930 1.6120 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7960 1.8590 0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5910 -0.8790 -0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 -3.2750 -2.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 -3.1040 -3.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4960 0.2280 2.4720 O 0 5 0 0 0 0 0 0 0 0 0 0 1.7920 -4.3830 -5.0410 O 0 5 0 0 0 0 0 0 0 0 0 0 0.3980 -0.5750 -4.7040 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7610 -1.2020 -5.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 0.3670 -4.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6270 -0.5740 -4.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 22 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 11 19 1 0 0 0 0 12 13 2 0 0 0 0 12 21 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 M CHG 1 20 -1 M CHG 1 21 -1 M CHG 1 22 1 M END