PUBCHEM-ZINC00998111 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 33 0 0 1 0 0 0 0 0999 V2000 -0.5580 2.0740 -1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 0.6300 -1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 0.2660 -1.4950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9860 -0.2570 -0.5180 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 0.0910 -0.1280 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8920 0.4100 -1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1060 -1.0800 0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7130 -2.1200 1.1430 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 -1.6540 -0.2450 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7740 -2.2830 -1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 -1.7310 0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 -0.6000 0.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8150 -0.6700 1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4960 -1.8710 0.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8530 -3.0020 0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5280 -2.9330 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 -4.1440 -0.3840 N 0 3 0 0 0 0 0 0 0 0 0 0 1.4360 -5.2040 -0.4460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3290 -4.0820 -0.7300 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.2900 1.2400 0.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2630 1.4860 1.4320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 2.6220 -1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 2.1340 -1.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6940 2.5080 -0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7240 -0.7290 1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7050 -1.6210 -0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 0.3380 0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3180 0.2130 1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5300 -1.9260 1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3840 -3.9400 0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3820 1.9890 1.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2990 2.7150 1.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 20 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 9 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 16 2 0 0 0 0 12 13 2 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 14 15 2 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 2 0 0 0 0 20 31 1 0 0 0 0 31 32 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END