PUBCHEM-ZINC02700351 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 0 0 0 0 0 0999 V2000 0.1320 1.4030 -0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -0.0960 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.7410 1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 -2.2120 1.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 -3.0310 0.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -2.5190 2.7140 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -1.4630 3.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -1.4910 5.2630 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 0.0430 2.6950 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -3.9360 3.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4930 -4.5230 3.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4430 -3.7240 2.9530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -0.8140 -1.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 -0.9000 -2.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 -1.5670 -3.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.1490 -3.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -2.0730 -3.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -1.4010 -1.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -2.7960 -4.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 -3.2190 -5.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 1.6700 -0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 1.7720 -0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2410 1.9580 0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 -4.0600 4.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4970 -4.5300 2.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 -0.4560 -1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 -1.6410 -3.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1200 -2.5280 -3.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1420 -1.3500 -1.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 -5.7500 3.5030 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 12 2 0 0 0 0 11 30 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 28 1 0 0 0 0 18 29 1 0 0 0 0 19 20 1 0 0 0 0 M CHG 1 30 -1 M END