PUBCHEM-ZINC02877665 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 0 0 0 0 0 0999 V2000 -0.1910 1.6970 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2650 0.1960 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 -0.4000 1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 -1.7770 1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4030 -2.5630 0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -1.9740 -1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 -0.5900 -1.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 0.0100 -2.4110 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -0.6570 -3.7410 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 0.2540 -4.7920 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 -1.9920 -3.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5300 -0.6340 -3.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3080 -1.2230 -4.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5690 -2.5800 -4.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2820 -3.1210 -5.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7340 -2.3040 -6.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4720 -0.9460 -6.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7640 -0.4060 -5.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6290 -2.9830 -7.9290 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.4770 -4.0360 0.3010 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.6140 -4.5570 1.3940 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4010 -4.7290 -0.6980 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8480 2.0160 -0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5930 2.0110 -1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 2.1500 0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 0.2110 2.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6100 -2.2400 2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 -2.5880 -1.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 0.8160 -2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7110 -1.2220 -2.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8520 0.3940 -3.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2160 -3.2180 -3.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4850 -4.1820 -5.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8250 -0.3080 -7.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5640 0.6550 -5.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END