PUBCHEM-ZINC05431485 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 24 0 0 1 0 0 0 0 0999 V2000 -0.0050 1.3700 -0.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 -0.0960 -0.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -0.5760 -1.9150 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 -0.8020 0.1570 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0310 -2.2460 0.1470 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2040 -2.7520 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 -2.5830 -0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3870 -2.2980 -2.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9660 -2.8330 -2.7620 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.9760 -4.3330 -2.7940 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5680 -2.2630 -4.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 -2.7820 1.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3870 -1.8790 2.4670 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 1.7770 -1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 1.8900 -0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 1.5310 0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0410 -0.3580 1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6080 -3.6440 -0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1830 -2.0180 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3020 -1.2250 -2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5730 -2.8240 -2.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6530 -2.7470 -4.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3950 -2.5280 -5.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4420 -1.1780 -4.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 -4.0240 1.7520 O 0 5 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 8 20 1 0 0 0 0 8 21 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 22 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 12 13 2 0 0 0 0 12 25 1 0 0 0 0 M CHG 1 25 -1 M END