PUBCHEM-ZINC06578525 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 1.5620 2.5550 -0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 1.8530 2.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2380 1.6780 3.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4560 2.9540 3.4100 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 3.4590 2.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 3.6710 1.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3710 3.5760 4.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 3.1520 5.6240 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 3.9400 6.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9090 3.6900 7.7840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 5.1200 6.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 6.1110 7.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2340 6.2200 8.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 6.7870 8.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 6.8530 10.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 6.3570 11.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 5.8010 11.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 5.7340 9.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6010 6.4750 12.4740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9790 5.9260 13.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 5.0540 4.9760 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0310 1.5860 -0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 3.3020 -0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 2.8780 -1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0450 2.5770 2.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7290 0.8950 1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 0.9170 2.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 1.3020 4.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 2.7280 1.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7000 4.3990 2.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 3.9420 0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 4.4410 1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 6.9250 7.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 7.1650 8.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5950 7.2850 10.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 5.4030 11.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 5.2880 9.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 6.4450 13.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 4.8480 13.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6560 6.0760 14.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 2.3850 0.7910 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0950 1.6760 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 6 41 1 0 0 0 0 7 8 2 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 41 42 1 0 0 0 0 M CHG 1 41 1 M END