PUBCHEM-ZINC05828917 MOE2007 3D CORINA 3.40 0006 02.08.2006 21 20 0 0 0 0 0 0 0 0999 V2000 -0.0910 1.5630 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 0.2240 0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 -0.3910 -1.5310 S 0 5 0 0 0 0 0 0 0 0 0 0 -0.8790 3.5280 1.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 4.3310 1.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 3.6470 1.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0310 1.2760 1.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2790 1.0810 3.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2350 1.2000 3.7850 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 2.3410 -0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 1.5190 -0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4730 0.3750 0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -0.5030 0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5350 3.7250 2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 3.8540 0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9890 0.2820 1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8470 1.8350 1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 2.0040 1.2190 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0760 1.7910 2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 5.5590 1.2640 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.4720 0.8380 3.4070 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 1 0 0 0 0 1 11 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 12 1 0 0 0 0 2 13 1 0 0 0 0 4 5 1 0 0 0 0 4 14 1 0 0 0 0 4 15 1 0 0 0 0 4 18 1 0 0 0 0 5 6 2 0 0 0 0 5 20 1 0 0 0 0 7 8 1 0 0 0 0 7 16 1 0 0 0 0 7 17 1 0 0 0 0 7 18 1 0 0 0 0 8 9 2 0 0 0 0 8 21 1 0 0 0 0 18 19 1 0 0 0 0 M CHG 1 3 -1 M CHG 1 18 1 M CHG 1 20 -1 M CHG 1 21 -1 M END