PUBCHEM-ZINC06904833 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3060 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -0.7400 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 -1.6760 1.1120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7790 -3.0110 0.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 -3.9420 0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6570 -4.6580 1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5770 -5.5120 0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6210 -5.6500 -0.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7460 -4.9350 -1.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8230 -4.0840 -1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6070 -6.5640 -1.4290 N 0 3 0 0 0 0 0 0 0 0 0 0 5.3780 -7.1940 -0.7280 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6460 -6.6860 -2.6400 O 0 5 0 0 0 0 0 0 0 0 0 0 2.0890 -1.2240 2.5320 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4750 -2.4250 3.1850 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0050 -0.1880 2.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 -0.4880 3.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -1.2710 4.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 -0.6940 5.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1090 0.6670 5.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 1.4500 4.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 0.8730 3.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 2.9330 4.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6480 3.2780 5.0580 F 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 3.6260 4.5170 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 3.2700 2.8680 F 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 1.8580 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8330 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 -1.2910 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 -0.0240 0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 -3.3860 1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 -2.9560 0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6220 -4.5500 2.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2600 -6.0710 1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7810 -5.0430 -2.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 -3.5280 -1.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 -2.3340 4.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4550 -1.3050 5.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8720 1.1180 5.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 1.4850 2.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 15 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M END