PUBCHEM-ZINC02058721 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 0 0 0 0 0 0999 V2000 1.1430 -0.8760 -0.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 -0.1950 -0.8390 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 -0.7600 -0.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 -1.9480 0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4300 -2.5240 0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6390 -1.9110 0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6270 -0.7150 -0.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4280 -0.1440 -0.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4130 1.1230 -1.5850 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.4620 1.6630 -1.8890 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 1.6260 -1.9100 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.9160 -2.5210 0.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0780 -1.8480 0.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4480 -2.3440 0.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6920 -3.4820 0.9960 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3980 -1.4610 0.3800 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.0620 -0.2260 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1360 1.0520 -0.3870 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.2910 -0.1610 -0.0420 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.7470 -1.8180 0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4960 -1.3380 1.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8260 -1.6910 1.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4120 -2.5230 0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6680 -3.0040 -0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3390 -2.6480 -0.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4080 -4.0480 -1.4760 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.0120 -0.3210 -0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 -0.9520 0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 -1.8760 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3030 -2.4190 0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4330 -3.4470 1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5570 -0.2380 -0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9290 -3.5060 1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0390 -0.6890 2.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4080 -1.3170 2.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4520 -2.7980 0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7600 -3.0200 -1.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 32 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 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 19 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 20 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 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 23 24 2 0 0 0 0 23 36 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 37 1 0 0 0 0 M CHG 1 9 1 M CHG 1 11 -1 M END