#------------------------------------------------------------------------------ #$Date: 2013-05-05 17:21:46 +0300 (Sun, 05 May 2013) $ #$Revision: 85285 $ #$URL: file:///home/coder/svn-repositories/cod/cif/9/00/80/9008088.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_9008088 loop_ _publ_author_name 'Mooney-Slater R C L' _publ_section_title ; Polymorphic forms of bismuth phosphate Locality: synthetic ; _journal_name_full 'Zeitschrift fur Kristallographie' _journal_page_first 371 _journal_page_last 385 _journal_volume 117 _journal_year 1962 _chemical_formula_sum 'Bi O4 P' _chemical_name_mineral Ximengite _space_group_IT_number 152 _symmetry_space_group_name_Hall 'P 31 2"' _symmetry_space_group_name_H-M 'P 31 2 1' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 120 _cell_length_a 6.966 _cell_length_b 6.966 _cell_length_c 6.460 _cell_volume 271.475 _exptl_crystal_density_diffrn 5.578 _[local]_cod_chemical_formula_sum_orig 'Bi P O4' _cod_database_code 9008088 loop_ _symmetry_equiv_pos_as_xyz x,y,z y,x,-z -y,x-y,1/3+z -x,-x+y,1/3-z -x+y,-x,2/3+z x-y,-y,2/3-z loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv Bi 0.46600 0.00000 0.83333 0.01226 P 0.46600 0.00000 0.33333 0.01226 O1 0.41800 0.16200 0.46000 0.01226 O2 0.66300 0.13500 0.18200 0.01226