#------------------------------------------------------------------------------ #$Date: 2015-01-27 19:58:39 +0000 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: svn://www.crystallography.net/cod/cif/1/01/08/1010886.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/ # # All data on this site have been placed in the public domain by the # contributors. # data_1010886 loop_ _publ_author_name 'Tazaki, H' _publ_section_title 'Single crystals of metaboric acid.' _journal_coden_ASTM JSHAAO _journal_name_full ; Journal of Science of the Hiroshima University, Series A: Mathematics, Physics, Chemistry ; _journal_page_first 37 _journal_page_last 54 _journal_volume 10 _journal_year 1940 _chemical_formula_structural 'H B O2' _chemical_formula_sum 'H B O2' _chemical_name_systematic 'Metaboric acid - $-ALPHA' _space_group_IT_number 62 _symmetry_cell_setting orthorhombic _symmetry_Int_Tables_number 62 _symmetry_space_group_name_Hall '-P 2ac 2n' _symmetry_space_group_name_H-M 'P n m a' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 12 _cell_length_a 8.015 _cell_length_b 9.679 _cell_length_c 6.244 _cell_volume 484.4 _cod_database_code 1010886 loop_ _symmetry_equiv_pos_as_xyz x,y,z 1/2+x,1/2-y,1/2-z -x,1/2+y,-z 1/2-x,-y,1/2+z -x,-y,-z 1/2-x,1/2+y,1/2+z x,1/2-y,z 1/2+x,y,1/2-z loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z ? ? ? ?