PUBCHEM-ZINC02849715 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.2470 1.2670 0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 -0.0930 0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 -0.6950 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 0.0720 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1360 1.4370 0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9020 2.0330 0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2980 2.2120 0.1740 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3340 3.6490 -0.6490 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2070 4.3930 -0.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6680 4.1300 -0.5560 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0550 3.2830 -2.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7630 3.1690 -2.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5440 2.8820 -4.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6160 2.7100 -5.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 2.8250 -4.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1270 3.1160 -3.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 2.4020 -6.4470 N 0 3 0 0 0 0 0 0 0 0 0 0 1.2430 2.3000 -6.8690 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3250 2.2500 -7.2010 O 0 5 0 0 0 0 0 0 0 0 0 0 1.1260 -2.0710 -0.2920 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0330 -2.5600 -1.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8470 -1.8150 -1.6750 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0390 -3.9890 -1.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9040 -4.6010 -2.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 -5.9530 -2.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6770 -6.4330 -1.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 -5.1910 -0.8280 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 1.7340 0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 -0.6890 0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1690 -0.3940 -0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 3.0960 0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0840 1.9090 0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 3.3030 -2.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 2.7920 -4.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7450 2.6900 -5.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1360 3.2100 -2.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 -2.6740 0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6820 -4.0760 -2.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2840 -6.5820 -3.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3740 -7.4690 -1.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 38 1 0 0 0 0 25 26 2 0 0 0 0 25 39 1 0 0 0 0 26 27 1 0 0 0 0 26 40 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END