PUBCHEM-ZINC05764914 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7940 1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -0.5210 2.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -1.5610 3.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -2.8830 2.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -3.1640 1.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -2.1260 0.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -2.0730 -0.7180 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -2.8310 -1.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.7530 -1.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 -0.1490 -2.7280 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -1.7160 -3.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 -3.9020 3.8440 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -5.2320 3.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -1.2960 4.7210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 0.0790 5.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 0.5010 2.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -4.1880 1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 -1.5160 -4.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8730 -2.2760 -3.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9060 -2.3000 -3.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9890 -5.3700 2.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -5.9450 4.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7900 -5.3940 2.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 0.1500 6.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 0.5800 4.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8480 0.5570 4.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 11 2 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 21 1 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 6 7 2 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 23 1 0 0 0 0 13 24 1 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 15 26 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 17 29 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 M CHG 1 2 1 M END