PUBCHEM-ZINC05308839 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 2.1330 1.4000 0.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1450 0.0190 0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -0.6810 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 0.0000 -0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 1.3810 -0.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 2.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 3.4850 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 4.1720 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3770 3.5800 0.0910 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2950 5.6740 0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6560 6.1730 0.3110 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8120 7.5080 0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8360 8.2340 0.4510 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1550 8.0830 0.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4390 9.4070 0.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8000 9.6900 0.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5880 8.6030 0.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6540 7.1710 0.5000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.0550 9.0060 0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0410 10.4390 1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6600 10.9460 0.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -2.1610 0.0030 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0620 -2.7610 0.6500 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 -2.7780 -0.6440 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8640 1.9450 1.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8890 -0.5160 1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 -0.5490 -1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 1.9120 -1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 3.9610 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 6.1010 -0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7460 5.9570 1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6770 10.1720 0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5940 8.3380 1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5080 8.9940 -0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1100 10.4290 2.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8400 11.0380 0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7420 11.4500 -0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2360 11.6190 1.5790 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 29 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 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END