#------------------------------------------------------------------------------ #$Date: 2009-11-23 07:50:56 +0200 (Mon, 23 Nov 2009) $ #$Revision: 903 $ #$URL: file:///home/coder/svn-repositories/cod/cif/9/9012319.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_9012319 loop_ _publ_author_name 'Glemser, O.' 'Einerhand, J.' _publ_section_title ; Die struktur hoherer nickelhydroxyde Locality: synthetic ; _journal_name_full 'Zeitschrift fur Anorganische und Allgemeine Chemie' _journal_page_first 43 _journal_page_last 51 _journal_volume 261 _journal_year 1950 _chemical_formula_sum 'H2 Ni O2' _chemical_name_mineral Jamborite _space_group_IT_number 166 _symmetry_space_group_name_Hall '-P 3* 2' _symmetry_space_group_name_H-M 'R -3 m :R' _cell_angle_alpha 23 _cell_angle_beta 23 _cell_angle_gamma 23 _cell_length_a 7.07 _cell_length_b 7.07 _cell_length_c 7.07 _cell_volume 47.352 _[local]_cod_data_source_file 12204.cif _[local]_cod_data_source_block global _[local]_cod_cif_authors_sg_H-M 'R -3 m' _[local]_cod_chemical_formula_sum_orig 'Ni O2 H2' loop_ _symmetry_equiv_pos_as_xyz x,y,z -x,-z,-y -z,-x,-y y,x,z y,z,x -z,-y,-x -x,-y,-z x,z,y z,x,y -y,-x,-z -y,-z,-x z,y,x loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Ni 0.00000 0.00000 0.00000 1.00000 O 0.37700 0.37700 0.37700 0.50000 O-H 0.37700 0.37700 0.37700 0.50000