PUBCHEM-ZINC00645309 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 1.2240 1.5770 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 0.2990 0.0730 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 -0.5980 1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2210 -1.2340 1.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -2.1620 2.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3930 -2.4700 3.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4320 -1.8530 2.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1460 -0.9210 1.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1690 -0.4580 -1.4390 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 -1.6160 -1.2510 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 0.5630 -2.4100 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6480 -1.1170 -2.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 -2.4210 -1.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3900 -2.6300 -2.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 -1.3230 -3.1560 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5190 -0.4190 -2.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2490 -3.7750 -1.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8470 -4.9290 -2.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4960 -3.3970 -1.5030 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6230 -4.1730 -1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6650 -5.5620 -1.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8200 -6.2660 -0.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9350 -5.5880 -0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9010 -4.2000 -0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7500 -3.4730 -0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7150 -1.9640 -0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6170 -1.3880 -0.8200 O 0 5 0 0 0 0 0 0 0 0 0 0 2.2300 1.4400 -0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 2.3000 -0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 2.0140 1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -1.0100 1.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 -2.6520 3.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6200 -3.1980 3.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4650 -2.1030 2.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9700 -0.4680 0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5840 -3.1370 -1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4080 0.5780 -3.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6730 -2.3730 -1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8140 -6.1170 -1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8470 -7.3460 -1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8320 -6.1370 -0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7750 -3.6780 0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7580 -1.3920 -0.0630 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 16 2 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 43 2 0 0 0 0 M CHG 1 27 -1 M END