#------------------------------------------------------------------------------ #$Date: 2008-04-05 11:13:02 +0300 (Sat, 05 Apr 2008) $ #$Revision: 340 $ #$URL: file:///home/coder/svn-repositories/cod/cif/2/2101503.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/. The original data for this entry # were provided by IUCr Journals, http://journals.iucr.org/. # # 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_2101503 loop_ _publ_author_name 'Hamada, E.' 'Ishizawa, N.' 'Marumo, F.' 'Ohsumi, K.' 'Shimizugawa, Y.' 'Reizen, K.' 'Matsunami, T.' _publ_section_title ; Structure of Mg~6~SO~2~(OH)~14~ determined by micro single-crystal X-ray diffraction ; _journal_issue 2 _journal_name_full 'Acta Crystallographica Section B' _journal_page_first 266 _journal_page_last 269 _journal_volume 52 _journal_year 1996 _chemical_formula_sum 'H14 Mg6 O16 S' _symmetry_cell_setting orthorhombic _symmetry_space_group_name_Hall '-C 21 -2c' _symmetry_space_group_name_H-M 'C c m m' _cell_angle_alpha 90.0 _cell_angle_beta 90.0 _cell_angle_gamma 90.0 _cell_formula_units_Z 2 _cell_length_a 15.8950(10) _cell_length_b 3.1050(10) _cell_length_c 13.3670(10) _cell_volume 659.64(3) _diffrn_radiation_wavelength 1.00 _exptl_crystal_density_diffrn 2.3 _[local]_cod_data_source_file oh0055.cif loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv Mg(1) .0 .0 .0 .018 Mg(2) .3748(5) .0 .1322 .012 S .1929(12) .0 .25 .011 O(1) .3887(13) .5 .25 .012 O(2) .1404(16) .370(16) .25 .026 O(3) .0028(10) .5 .1066(10) .009 O(4) .1290(9) .0 -.0340(10) .011 O(5) .2441(10) .0 .1511(11) .025