PUBCHEM-ZINC06169996 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6190 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 0.1360 2.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8460 -0.5010 3.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8980 -1.8990 3.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 -2.6440 2.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 -2.0110 1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3740 -4.1220 2.2090 N 0 3 0 0 0 0 0 0 0 0 0 0 1.9310 -4.6780 3.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 -4.7820 1.3230 O 0 5 0 0 0 0 0 0 0 0 0 0 2.4640 0.2960 4.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0830 -0.3210 5.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6790 0.4480 6.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6340 1.6640 6.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3560 -0.2260 7.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4100 -1.6210 7.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0440 -2.2440 8.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6260 -1.4900 9.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5750 -0.1060 9.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9490 0.5290 8.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1980 0.6920 10.5180 N 0 3 0 0 0 0 0 0 0 0 0 0 6.1540 1.9090 10.4780 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7550 0.1330 11.4460 O 0 5 0 0 0 0 0 0 0 0 0 0 6.4210 -2.2810 10.8100 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 1.2140 2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3920 -2.3940 3.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4230 1.3750 4.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1240 -1.3990 5.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9570 -2.2100 6.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0860 -3.3220 8.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9150 1.6070 8.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -2.7510 0.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 -2.9560 -0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 35 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 36 37 1 0 0 0 0 M CHG 1 9 1 M CHG 1 11 -1 M CHG 1 22 1 M CHG 1 24 -1 M END