PUBCHEM-ZINC05041854 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 36 0 0 0 0 0 0 0 0999 V2000 -0.2620 1.5080 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -0.6370 0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 -2.0150 0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -2.7580 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.1110 -0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 -0.7320 -0.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7400 -2.8980 -1.7790 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.4450 -2.3290 -2.5930 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7390 -4.1150 -1.7180 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0890 -4.1540 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 -4.8270 1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 -3.9790 2.6270 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 -6.1680 1.1280 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 -6.9000 2.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 -8.3960 2.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 -9.1600 3.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 -10.5570 3.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -11.3660 4.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4450 1.9200 -0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2730 1.8110 -0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 1.8810 1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 -0.0590 1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4950 -2.5150 1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6640 -0.2290 -1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -4.6380 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 -6.6480 0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 -6.5490 2.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3670 -6.7290 3.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -8.7460 1.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5220 -8.5660 1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -8.8090 3.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 -8.9890 4.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 -12.4120 4.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9730 -11.0610 4.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 -11.2410 4.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 M CHG 1 8 1 M CHG 1 10 -1 M END