#------------------------------------------------------------------------------ #$Date: 2008-01-26 15:05:32 +0200 (Sat, 26 Jan 2008) $ #$Revision: 19 $ #$URL: file:///home/coder/svn-repositories/cod/cif/9/9009553.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_9009553 _chemical_name 'Tarbuttite' loop_ _publ_author_name 'Genkina E A' 'Maksimov B A' 'Mel'nikov O K' _journal_name_full "Doklady Akademii Nauk SSSR" _journal_volume 282 _journal_year 1985 _journal_page_first 314 _journal_page_last 317 _publ_section_title ; Crystal structure of synthetic tarbutite Zn2[PO4](OH) Locality: synthetic ; _chemical_formula_sum 'Zn2 P O5 H' _cell_length_a 5.5517 _cell_length_b 5.7001 _cell_length_c 6.4707 _cell_angle_alpha 102.67 _cell_angle_beta 102.81 _cell_angle_gamma 86.88 _cell_volume 194.805 _symmetry_space_group_name_H-M 'P -1' loop_ _symmetry_equiv_pos_as_xyz 'x,y,z' '-x,-y,-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_Uiso_or_equiv Zn1 0.38620 0.24820 0.49160 0.00557 Zn2 0.02760 0.73840 0.18970 0.00393 P 0.83710 0.24970 0.27570 0.00279 O1 0.77590 0.99350 0.14980 0.01254 O2 0.94210 0.38450 0.13360 0.00950 O3 0.60290 0.37820 0.33420 0.00861 O4 0.96960 0.75140 0.51370 0.00887 O5 0.35950 0.88720 0.29540 0.01077 H 0.42800 0.94600 0.19300 0.01988