PUBCHEM-ZINC06129883 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 0 0 0 0 0 0999 V2000 4.6570 -4.0160 -4.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5890 -3.9890 -3.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7980 -4.3160 -2.3290 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6510 -4.6160 -1.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6790 -4.1970 -1.6060 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 -3.8410 -2.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3250 -3.6660 -3.7970 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -3.5230 -2.2110 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 -4.7110 -0.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 -4.4330 0.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -3.1600 0.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3830 -2.9110 2.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 -1.5150 2.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 -0.9580 1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1170 -1.9330 0.3630 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 0.3980 0.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4100 1.1330 0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 2.4380 0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 3.0210 -0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 2.3150 -0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 0.9910 0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2400 2.9750 -0.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3280 2.3430 -0.5020 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.3600 -6.2110 -1.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7380 -6.9910 -0.4320 O 0 5 0 0 0 0 0 0 0 0 0 0 5.0750 -5.0230 -4.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2650 -3.7160 -5.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4640 -3.3280 -4.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3190 -5.2590 1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 -3.6710 3.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -0.9820 3.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3330 0.6850 1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3560 3.0040 0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 4.0420 -0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 0.4280 0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1350 4.1240 -1.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 -6.5050 -2.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 29 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 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 36 2 0 0 0 0 24 25 1 0 0 0 0 24 37 2 0 0 0 0 M CHG 1 23 -1 M CHG 1 25 -1 M END