#------------------------------------------------------------------------------ #$Date: 2013-05-05 17:21:46 +0300 (Sun, 05 May 2013) $ #$Revision: 85285 $ #$URL: file:///home/coder/svn-repositories/cod/cif/9/00/74/9007425.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_9007425 loop_ _publ_author_name 'Mooney, R. C. L.' _publ_section_title ; Crystal structure of tetragonal bismuth arsenate, BiAsO4 Locality: synthetic ; _journal_name_full 'Acta Crystallographica' _journal_page_first 163 _journal_page_last 165 _journal_volume 1 _journal_year 1948 _chemical_formula_sum 'As Bi O4' _chemical_name_mineral Tetrarooseveltite _space_group_IT_number 88 _symmetry_space_group_name_Hall 'I 4bw -1bw' _symmetry_space_group_name_H-M 'I 41/a :1' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_length_a 5.08 _cell_length_b 5.08 _cell_length_c 11.70 _cell_volume 301.935 _exptl_crystal_density_diffrn 7.653 _[local]_cod_cif_authors_sg_H-M 'I 41/a' _[local]_cod_chemical_formula_sum_orig 'Bi As O4' _cod_database_code 9007425 loop_ _symmetry_equiv_pos_as_xyz x,y,z 1/2+x,1/2+y,1/2+z 1/2+y,1/2-x,1/2-z +y,-x,-z -y,1/2+x,1/4+z 1/2-y,+x,3/4+z 1/2+x,y,3/4-z +x,1/2+y,1/4-z 1/2-x,1/2-y,1/2+z -x,-y,+z -y,x,-z 1/2-y,1/2+x,1/2-z 1/2+y,-x,3/4+z +y,1/2-x,1/4+z -x,1/2-y,1/4-z 1/2-x,-y,3/4-z loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z Bi3+ 0.00000 0.00000 0.50000 As 0.00000 0.00000 0.00000 O 0.21300 0.14900 0.08000