PUBCHEM-ZINC01068347 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 0 0 0 0 0 0999 V2000 -0.2420 1.4860 -0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 -0.0160 -0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 -0.5990 1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 -1.9780 1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 -2.7820 0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 -2.2180 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 -0.8110 -1.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 -0.2100 -2.5440 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2910 -0.9580 -3.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2950 -2.3380 -3.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 -2.9710 -2.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 -4.4530 -2.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0650 -5.0610 -1.6880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 -5.0370 -3.2650 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6530 -6.4620 -3.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 -6.7050 -4.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2800 -6.9060 -5.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5680 -7.0560 -6.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5290 -7.0020 -7.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 -6.7970 -7.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 -6.6500 -5.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8990 -7.1520 -9.4530 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 -6.2600 -10.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2780 -6.6790 -9.5340 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 -8.6920 -9.8010 N 0 5 0 0 0 0 0 0 0 0 0 0 0.7320 -8.8870 -9.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3060 -0.2170 -4.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5380 0.1230 -5.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 0.8080 -6.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 1.1710 -7.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 0.8510 -6.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 0.1590 -5.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4390 -0.2270 -4.9630 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6410 1.8320 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1470 1.8180 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 1.9690 0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1710 0.0250 1.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 -2.4300 2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 -3.8600 0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 -2.9040 -4.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3030 -4.4670 -3.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4280 -6.8970 -2.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -6.9250 -3.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0950 -6.9320 -4.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5940 -7.2030 -7.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 -6.7460 -8.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 -6.4760 -5.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4700 -0.1470 -5.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5530 1.0590 -7.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 1.7050 -8.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 1.1420 -7.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 4 5 2 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 40 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 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 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 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 30 31 2 0 0 0 0 30 50 1 0 0 0 0 31 32 1 0 0 0 0 31 51 1 0 0 0 0 32 33 1 0 0 0 0 M CHG 1 25 -1 M END