#------------------------------------------------------------------------------ #$Date: 2013-05-09 16:53:25 +0300 (Thu, 09 May 2013) $ #$Revision: 86000 $ #$URL: file:///home/coder/svn-repositories/cod/cif/9/01/60/9016011.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/. The original data for this entry # were provided the American Mineralogist Crystal Structure Database, # http://rruff.geo.arizona.edu/AMS/amcsd.php # # The file may be used within the scientific community so long as # proper attribution is given to the journal article from which the # data were obtained. # data_9016011 loop_ _publ_author_name 'Durif, A.' 'Averbuch-Pouchot M' _publ_section_title ; Crystal structure of a silver phosphate-tellurate: Te(OH)6(Ag2HPO4)2 _cod_database_code 1007045 ; _journal_name_full 'Zeitschrift fur Anorganische und Allgemeine Chemie' _journal_page_first 129 _journal_page_last 132 _journal_volume 472 _journal_year 1981 _chemical_formula_sum 'Ag4 O14 P2 Te' _space_group_IT_number 14 _symmetry_space_group_name_Hall '-P 2yn' _symmetry_space_group_name_H-M 'P 1 21/n 1' _cell_angle_alpha 90 _cell_angle_beta 119.89 _cell_angle_gamma 90 _cell_length_a 5.950 _cell_length_b 20.52 _cell_length_c 5.829 _cell_volume 617.020 _database_code_amcsd 0015785 _exptl_crystal_density_diffrn 4.548 _[local]_cod_chemical_formula_sum_orig 'Te Ag4 P2 O14' _cod_database_code 9016011 _amcsd_formula_title Te(OH)6(Ag2HPO4)2 loop_ _space_group_symop_operation_xyz x,y,z 1/2+x,1/2-y,1/2+z 1/2-x,1/2+y,1/2-z -x,-y,-z loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z Te1 0.00000 0.00000 0.00000 Ag1 0.05220 0.19213 0.02320 Ag2 0.13440 0.38728 0.80460 P1 0.89480 0.33423 0.18420 O1 0.36600 0.01310 0.20200 O2 0.02700 0.92040 0.18900 O3 -0.05100 0.05050 0.24600 O4 0.43800 0.18750 0.45900 O5 0.63600 0.29910 0.14300 O6 0.11700 0.31320 0.46500 O7 0.84100 0.40710 0.18100