PUBCHEM-ZINC05930478 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 0 0 0 0 0 0999 V2000 -0.5390 1.3160 0.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -0.0230 0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3860 -0.7910 1.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 -2.2580 1.3480 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 -1.8630 -0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 -0.6780 -0.4890 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1940 -1.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 0.2450 -2.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1750 1.3250 -2.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3170 1.7910 -2.5530 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7810 1.1450 -3.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1510 0.0890 -4.2050 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0050 -0.3470 -3.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4430 -1.4190 -4.2980 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0500 1.6610 -4.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9550 2.1650 -3.4120 F 0 0 0 0 0 0 0 0 0 0 0 0 5.7290 0.7040 -5.0010 F 0 0 0 0 0 0 0 0 0 0 0 0 4.8090 2.6660 -5.1930 F 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -0.5030 3.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 -0.8990 3.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8650 -0.0640 4.6150 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6980 1.2740 4.1340 P 0 0 0 0 0 0 0 0 0 0 0 0 -3.7860 0.7230 3.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 1.8790 -0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6220 1.2220 0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 1.9350 1.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3550 -2.5170 -1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -1.0100 -2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 0.6200 -1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8450 1.8790 -1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 -1.8680 -4.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9660 -1.7570 -5.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 -1.0450 3.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 0.5550 3.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0060 -0.8780 2.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3680 -1.9300 3.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1990 1.8720 5.4370 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.6540 2.1160 3.4140 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 7 29 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 30 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 M CHG 1 6 1 M CHG 1 37 -1 M CHG 1 38 -1 M END