#------------------------------------------------------------------------------ #$Date: 2013-05-03 00:18:17 +0300 (Fri, 03 May 2013) $ #$Revision: 85102 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/51/16/1511623.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_1511623 loop_ _publ_author_name 'Chuchman, T.D.' 'Kuz'ma, Yu.B.' 'Mikhalenko, S.I.' _publ_section_title ; Interaction in Pr-Mn-B and Nd-Mn-B ternary systems ; _journal_name_full 'Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy' _journal_page_first 2295 _journal_page_last 2300 _journal_volume 26 _journal_year 1990 _chemical_formula_sum 'B6 Mn2.53 Pr4.47' _chemical_name_systematic 'Pr4.47 Mn2.53 B6' _space_group_IT_number 166 _symmetry_space_group_name_Hall '-R 3 2"' _symmetry_space_group_name_H-M 'R -3 m :H' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 120 _cell_formula_units_Z 3 _cell_length_a 5.489 _cell_length_b 5.489 _cell_length_c 24.257 _cell_volume 632.928 _citation_journal_id_ASTM IVNMAW _[local]_cod_data_source_file boron4-x_276.cif _[local]_cod_data_source_block B6Mn2.53Pr4.47 _cod_original_cell_volume 632.9278 _cod_database_code 1511623 loop_ _symmetry_equiv_pos_as_xyz x,y,z -y,x-y,z -x+y,-x,z y,x,-z -x,-x+y,-z x-y,-y,-z -x,-y,-z y,-x+y,-z x-y,x,-z -y,-x,z x,x-y,z -x+y,y,z x+2/3,y+1/3,z+1/3 -y+2/3,x-y+1/3,z+1/3 -x+y+2/3,-x+1/3,z+1/3 y+2/3,x+1/3,-z+1/3 -x+2/3,-x+y+1/3,-z+1/3 x-y+2/3,-y+1/3,-z+1/3 -x+2/3,-y+1/3,-z+1/3 y+2/3,-x+y+1/3,-z+1/3 x-y+2/3,x+1/3,-z+1/3 -y+2/3,-x+1/3,z+1/3 x+2/3,x-y+1/3,z+1/3 -x+y+2/3,y+1/3,z+1/3 x+1/3,y+2/3,z+2/3 -y+1/3,x-y+2/3,z+2/3 -x+y+1/3,-x+2/3,z+2/3 y+1/3,x+2/3,-z+2/3 -x+1/3,-x+y+2/3,-z+2/3 x-y+1/3,-y+2/3,-z+2/3 -x+1/3,-y+2/3,-z+2/3 y+1/3,-x+y+2/3,-z+2/3 x-y+1/3,x+2/3,-z+2/3 -y+1/3,-x+2/3,z+2/3 x+1/3,x-y+2/3,z+2/3 -x+y+1/3,y+2/3,z+2/3 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 Pr3 Pr 0 0 0.4168 1 0.0 B1 B 0.3333 0 0.5 1 0.0 Pr2 Pr 0 0 0.2482 1 0.0 Mn2 Mn 0 0 0.1197 1 0.0 Mn1 Mn 0 0 0 0.53 0.0 Pr1 Pr 0 0 0 0.47 0.0