PUBCHEM-ZINC02165329 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 1 0 0 0 0 0999 V2000 -0.0100 1.4730 0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 0.0240 -0.1340 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7130 -0.6360 0.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 -0.8530 0.2700 S 0 0 0 0 0 0 0 0 0 0 0 0 1.7890 -1.1170 -1.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.2240 -1.4640 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7820 0.7320 -1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 -0.8930 -2.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9900 -1.9550 -1.9610 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -0.4410 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 1.8270 0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 1.9800 -0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 1.6880 1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7410 0.0060 1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2650 -1.6010 1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5210 -0.7750 -2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5300 -2.1620 -1.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9400 -0.0420 -0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 -1.5300 -0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8940 -0.0950 0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 -0.3080 -3.4340 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6370 -0.7760 -3.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 14 1 0 0 0 0 3 15 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 5 17 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 21 1 0 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0 10 20 1 0 0 0 0 21 22 1 0 0 0 0 M CHG 1 2 1 M END