#------------------------------------------------------------------------------ #$Date: 2024-05-23 12:45:01 +0300 (Thu, 23 May 2024) $ #$Revision: 292002 $ #$URL: file:///home/coder/svn-repositories/cod/cif/9/01/47/9014787.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_9014787 loop_ _publ_author_name 'Averbuch-Pouchot, M. T.' _publ_section_title ; Structure du monophosphate acide de potassium-zinc. KZn2H(PO4)2 ; _journal_issue 6 _journal_name_full 'Acta Crystallographica, Section B' _journal_page_first 1452 _journal_page_last 1454 _journal_paper_doi 10.1107/S0567740879006695 _journal_volume 35 _journal_year 1979 _chemical_formula_sum 'K O8 P2 Zn2' _space_group_IT_number 2 _symmetry_space_group_name_Hall '-P 1' _symmetry_space_group_name_H-M 'P -1' _cell_angle_alpha 72.67 _cell_angle_beta 78.33 _cell_angle_gamma 76.09 _cell_length_a 9.432 _cell_length_b 8.907 _cell_length_c 5.220 _cell_formula_units_Z 2 _cell_volume 402.292 _database_code_amcsd 0015984 _exptl_crystal_density_diffrn 2.970 _cod_duplicate_entry 1008037 _cod_original_formula_sum 'Zn2 P2 K O8' _cod_database_code 9014787 _amcsd_formula_title ' KZn2H(PO4)2' loop_ _space_group_symop_operation_xyz x,y,z -x,-y,-z loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z Zn1 0.10770 0.11346 0.20612 Zn2 0.23689 0.38530 0.39337 P1 0.60270 0.75040 0.09610 P2 0.05370 0.75500 0.33230 K1 0.67790 0.30460 0.28770 O1 0.09860 0.23720 0.47970 O2 0.59700 0.69760 0.40210 O3 0.15440 0.59600 0.43510 O4 0.43790 0.81160 0.03640 O5 0.03340 0.77800 0.04080 O6 0.33500 0.39030 0.02710 O7 0.31500 0.11050 0.03530 O8 0.11950 0.88690 0.37180 loop_ _cod_related_entry_id _cod_related_entry_database _cod_related_entry_code 1 AMCSD 0015984