#------------------------------------------------------------------------------ #$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $ #$Revision: 176429 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/53/01/1530161.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_1530161 loop_ _publ_author_name 'Khodyrev, Yu.P.' 'Baranova, R.V.' 'Imamov, R.M.' 'Semiletov, S.A.' _publ_section_title ; Electron diffraction investigation of hexagonal nickel hydride ; _journal_name_full Kristallografiya _journal_page_first 724 _journal_page_last 728 _journal_volume 23 _journal_year 1978 _chemical_formula_sum 'H Ni2' _chemical_name_systematic 'Ni2 H' _space_group_IT_number 143 _symmetry_space_group_name_Hall 'P 3' _symmetry_space_group_name_H-M 'P 3' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 120 _cell_formula_units_Z 1 _cell_length_a 2.643 _cell_length_b 2.643 _cell_length_c 4.308 _cell_volume 26.062 _citation_journal_id_ASTM KRISAJ _cod_data_source_file Khodyrev_KRISAJ_1978_456.cif _cod_data_source_block H1Ni2 _cod_original_cell_volume 26.06157 _cod_original_formula_sum 'H1 Ni2' _cod_database_code 1530161 loop_ _symmetry_equiv_pos_as_xyz x,y,z -y,x-y,z -x+y,-x,z loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy _atom_site_U_iso_or_equiv Ni1 Ni 0.33333 0.66667 0.261 1 0.0 Ni2 Ni 0.66667 0.33333 0.796 1 0.0 H1 H 0 0 0.028 1 0.0