PUBCHEM-ZINC04095527 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 1 0 0 0 0 0999 V2000 -0.1110 1.5480 0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 0.0300 0.2470 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5260 -0.1910 -0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -0.5240 0.0360 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9510 -0.1140 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4920 -2.0500 -0.0320 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0320 -2.3850 -0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -2.6470 1.1710 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3580 -2.5030 2.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -1.9960 1.3300 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0880 -2.3610 2.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -0.5820 1.3890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4420 -2.4170 0.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 -4.0640 0.9600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -4.1590 0.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -2.5260 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7770 -3.4900 0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3790 -0.1380 1.1090 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1620 -0.7190 1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 2.0580 0.3030 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 3.6630 0.0340 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8280 3.8800 0.1470 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 3.8450 -1.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 2.0210 -0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4480 1.7920 1.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 -2.0470 0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 4.2900 1.0890 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 18 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 16 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 27 1 0 0 0 0 M CHG 1 27 -1 M END