PUBCHEM-ZINC06276910 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.3760 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 1.7530 -0.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1860 1.0840 -0.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.0300 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 -0.3460 0.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 0.3270 0.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6210 -0.6500 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7750 0.0380 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7550 1.7500 -0.1360 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9440 -0.6220 -0.2610 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1840 -0.0370 -0.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6280 1.2810 -0.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9730 1.5460 -0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8930 0.5090 -0.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4800 -0.7910 -0.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1190 -1.0850 -0.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3510 -2.3260 -0.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0950 -2.0130 -0.2740 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4430 2.9490 -0.5860 N 0 3 0 0 0 0 0 0 0 0 0 0 8.6420 3.8630 -0.5050 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6320 3.1900 -0.7000 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9040 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 2.5720 -1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9640 1.3780 -1.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5590 -1.1650 1.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 0.0350 1.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6380 -1.6170 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9200 2.0940 -0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9440 0.7340 -0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2020 -1.5910 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7560 -3.3270 -0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 2 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 31 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END