#------------------------------------------------------------------------------ #$Date: 2023-03-24 18:37:27 +0200 (Fri, 24 Mar 2023) $ #$Revision: 282053 $ #$URL: file:///home/coder/svn-repositories/cod/cif/9/01/10/9011018.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_9011018 loop_ _publ_author_name 'Giglio, M.' _publ_section_title ; Die kristallstruktur von Na2Zn(SO4)2*4H2O (Zn-blodit) ; _journal_name_full 'Acta Crystallographica' _journal_page_first 789 _journal_page_last 794 _journal_paper_doi 10.1107/S0365110X5800222X _journal_volume 11 _journal_year 1958 _chemical_compound_source Synthetic _chemical_formula_sum 'H8 Na2 O12 S2 Zn' _chemical_name_mineral Changoite _space_group_IT_number 14 _symmetry_space_group_name_Hall '-P 2yab' _symmetry_space_group_name_H-M 'P 1 21/a 1' _cell_angle_alpha 90 _cell_angle_beta 100.58 _cell_angle_gamma 90 _cell_length_a 11.05 _cell_length_b 8.23 _cell_length_c 5.54 _cell_volume 495.251 _database_code_amcsd 0009212 _exptl_crystal_density_diffrn 2.518 _cod_original_formula_sum 'Zn Na2 S2 O12 H8' _cod_database_code 9011018 loop_ _space_group_symop_operation_xyz x,y,z 1/2+x,1/2-y,z 1/2-x,1/2+y,-z -x,-y,-z loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv Zn 0.00000 0.00000 0.00000 0.00426 Na 0.36200 0.06500 0.12800 0.00426 S 0.13400 0.29400 0.37400 0.00426 O1 0.27200 0.26700 0.34400 0.00426 O2 0.07800 0.40700 0.17800 0.00426 O3 0.07200 0.12600 0.31500 0.00426 O4 0.12600 0.32000 0.64800 0.00426 Wat1 0.15800 0.04100 0.87000 0.00426 Wat2 0.42600 0.28200 0.78400 0.00426