PUBCHEM-ZINC02029118 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 33 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7020 1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0870 1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7830 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0840 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6840 -1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.7670 -2.3880 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 -2.1870 -3.6230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 -3.4450 -4.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 -3.3610 -5.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 -4.3390 -6.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 -5.4190 -6.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 -5.5160 -5.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3070 -4.5370 -4.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5170 -4.6360 -4.1030 N 0 3 0 0 0 0 0 0 0 0 0 0 3.3330 -5.6610 -4.2380 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7770 -3.7000 -3.2140 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.3940 -6.4730 -7.6700 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4670 -6.3850 -8.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 -7.5000 -7.8000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0640 -4.5190 0.0210 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1620 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6220 2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1380 -2.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 -3.6120 -2.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 -2.5230 -5.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8430 -4.2730 -7.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6940 -6.3600 -5.9860 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 22 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M CHG 1 19 1 M CHG 1 21 -1 M END