PUBCHEM-ZINC05495272 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 25 0 0 0 0 0 0 0 0999 V2000 0.0290 1.0230 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6300 1.4640 -1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 1.6080 -2.2990 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9510 1.7120 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5510 2.2420 -2.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 2.3580 -3.3930 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8460 2.6160 -2.3570 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4070 3.2460 -3.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7660 3.1250 -3.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3200 3.7450 -4.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5160 4.4910 -5.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1560 4.6120 -5.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6040 3.9960 -4.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -0.0640 0.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0630 1.3680 0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 1.4480 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5560 1.5090 -0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 1.9780 -3.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3890 2.4500 -1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3910 2.5450 -3.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3770 3.6500 -5.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5310 5.1920 -6.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5480 4.0940 -4.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2220 5.2820 -7.0940 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.5740 6.4890 -6.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 17 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 11 12 2 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 12 22 1 0 0 0 0 13 23 1 0 0 0 0 24 25 1 0 0 0 0 M END