#------------------------------------------------------------------------------ #$Date: 2012-02-28 17:44:07 +0200 (Tue, 28 Feb 2012) $ #$Revision: 35913 $ #$URL: file:///home/coder/svn-repositories/cod/cif/9/01/10/9011038.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_9011038 loop_ _publ_author_name 'Strunz, V. H.' 'Contag, B.' _publ_section_title ; Hexahydroxostannate Fe, Mn, Co, Mg, Ca[Sn(OH)6] und deren kristallstruktur Locality: synthetic ; _journal_name_full 'Acta Crystallographica' _journal_page_first 601 _journal_page_last 603 _journal_volume 13 _journal_year 1960 _chemical_formula_sum 'Fe H6 O6 Sn' _chemical_name_mineral Natanite _space_group_IT_number 224 _symmetry_space_group_name_Hall '-P 4bc 2bc 3' _symmetry_space_group_name_H-M 'P n -3 m :2' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_length_a 7.79 _cell_length_b 7.79 _cell_length_c 7.79 _cell_volume 472.729 _exptl_crystal_density_diffrn 3.886 _[local]_cod_cif_authors_sg_H-M 'P n 3 m' _[local]_cod_chemical_formula_sum_orig 'Fe Sn (O6 H6)' _cod_database_code 9011038 _amcsd_database_code AMCSD#0009176 loop_ _symmetry_equiv_pos_as_xyz x,y,z 1/2+z,-x,1/2+y 1/2-y,z,1/2-x 1/2+x,-y,1/2+z 1/2-z,x,1/2-y 1/2+y,-z,1/2+x 1/2-x,y,1/2-z x,1/2-z,1/2-y -z,1/2+y,1/2+x y,1/2-x,1/2-z -x,1/2+z,1/2+y z,1/2-y,1/2-x -y,1/2+x,1/2+z x,z,y -z,-y,-x y,x,z -x,-z,-y z,y,x -y,-x,-z 1/2+z,1/2+x,-y 1/2-y,1/2-z,x 1/2+x,1/2+y,-z 1/2-z,1/2-x,y 1/2+y,1/2+z,-x 1/2-x,1/2-y,z -z,1/2+x,1/2+y y,1/2-z,1/2-x -x,1/2+y,1/2+z z,1/2-x,1/2-y -y,1/2+z,1/2+x x,1/2-y,1/2-z 1/2-x,z,1/2-y 1/2+z,-y,1/2+x 1/2-y,x,1/2-z 1/2+x,-z,1/2+y 1/2-z,y,1/2-x 1/2+y,-x,1/2+z 1/2-x,1/2-z,y 1/2+z,1/2+y,-x 1/2-y,1/2-x,z 1/2+x,1/2+z,-y 1/2-z,1/2-y,x 1/2+y,1/2+x,-z -z,-x,-y y,z,x -x,-y,-z z,x,y -y,-z,-x loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z Fe 0.50000 0.50000 0.50000 Sn 0.00000 0.00000 0.00000 O-H 0.05620 0.05620 0.24800