PUBCHEM-ZINC05163063 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 0.5510 1.5290 1.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 0.2410 1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9710 -0.5650 0.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1420 -0.0190 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 1.3190 0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6450 2.1570 0.8860 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5810 1.5820 -0.4820 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9780 0.4240 -1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1390 -0.5700 -0.8830 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2890 2.8440 -0.4790 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9120 3.4150 0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2030 3.7540 -1.7350 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3910 4.4740 -1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5450 4.4940 -1.5930 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4370 5.3460 -0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4900 3.4370 -1.0150 C 0 0 3 0 0 0 0 0 0 0 0 0 6.9050 2.8120 -1.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6830 2.6030 -0.1630 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6240 4.0820 -0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8690 2.8490 0.3090 S 0 0 0 0 0 0 0 0 0 0 0 0 9.9380 3.9450 1.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0920 3.1510 1.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0000 4.0430 2.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0020 3.2830 3.2350 F 0 0 0 0 0 0 0 0 0 0 0 0 5.9850 4.9690 -2.8620 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4540 4.3620 -3.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2310 3.1000 -2.8950 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6040 -1.8820 0.2640 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 2.1380 1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8830 0.3740 -1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1320 4.8380 -0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2240 4.5560 0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3220 4.7390 0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3420 4.4030 2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7180 2.3410 2.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6900 2.6740 1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4550 4.8310 2.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4620 4.5030 3.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2510 -2.2080 0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -2.4840 -0.2890 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 29 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 27 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 25 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 22 23 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 25 26 1 0 0 0 0 28 39 1 0 0 0 0 28 40 1 0 0 0 0 M CHG 1 27 -1 M END