#------------------------------------------------------------------------------ #$Date: 2013-05-03 00:02:31 +0300 (Fri, 03 May 2013) $ #$Revision: 85014 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/51/15/1511556.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_1511556 loop_ _publ_author_name 'Babizhet'sky, V.S.' 'Guerin, R.' 'Mikhalenko, S.I.' 'Kuz'ma, Yu.B.' _publ_section_title ; Crystal structure of Pr2 B5 boride ; _journal_name_full Kristallografiya _journal_page_first 619 _journal_page_last 623 _journal_volume 48 _journal_year 2003 _chemical_formula_sum 'B5 Pr2' _chemical_name_systematic 'Pr2 B5' _space_group_IT_number 15 _symmetry_space_group_name_Hall '-C 2yc' _symmetry_space_group_name_H-M 'C 1 2/c 1' _cell_angle_alpha 90 _cell_angle_beta 109.607 _cell_angle_gamma 90 _cell_formula_units_Z 8 _cell_length_a 15.1603 _cell_length_b 7.2771 _cell_length_c 7.3137 _cell_volume 760.084 _citation_journal_id_ASTM KRISAJ _[local]_cod_data_source_file boron4-x_196.cif _[local]_cod_data_source_block B5Pr2 _cod_original_cell_volume 760.0844 _cod_database_code 1511556 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x,y,-z+1/2 -x,-y,-z x,-y,z-1/2 x+1/2,y+1/2,z -x+1/2,y+1/2,-z+1/2 -x+1/2,-y+1/2,-z x+1/2,-y+1/2,z-1/2 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 B3 B-1 0.1605 0.7518 0.9392 1 0.0 Pr1 Pr+3 0.11723 0.57111 0.59402 1 0.0 B1 B-1 0.2527 0.7888 0.831 1 0.0 Pr2 Pr+3 0.1172 0.06437 0.72161 1 0.0 B4 B-1 0.7502 0.16 0.411 1 0.0 B2 B-1 0.2502 0.921 0.0383 1 0.0 B5 B-1 0.459 0.255 0.653 1 0.0