PUBCHEM-ZINC05378687 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 21 0 0 0 0 0 0 0 0999 V2000 0.0060 1.4530 -0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.0280 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -0.5360 1.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.6780 -1.1570 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -2.0080 -1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -3.2090 -1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -4.6790 -1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -5.2770 -2.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -6.8010 -2.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -7.5550 -4.0040 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1610 -7.0660 -4.6210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 -7.0560 -4.6030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 1.7420 -0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 1.7370 -0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 1.9760 0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 -5.0240 -0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8470 -5.0290 -0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 -4.9250 -3.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9290 -4.9180 -2.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9410 -7.1660 -1.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8350 -7.1730 -1.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -8.9840 -3.6930 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 1 15 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 5 6 3 0 0 0 0 6 7 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 8 9 1 0 0 0 0 8 18 1 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 9 21 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 22 1 0 0 0 0 M CHG 1 22 -1 M END