#------------------------------------------------------------------------------ #$Date: 2008-01-13 22:15:36 +0000 (Sun, 13 Jan 2008) $ #$Revision: 14 $ #$URL: svn://www.crystallography.net/cod/cif/2/2000290.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_2000290 _journal_name_full 'Acta Cryst. C' _journal_year 1991 _journal_volume 47 _journal_page_first 1532 _journal_page_last 1534 loop_ _publ_author_name 'Lee, J.Y.' 'Swinnea, J.S.' 'Steinfink, H.' _chemical_formula_moiety '[Ca0.82Pr0.18]2[Co[Co0.65Al).35]]O5' _chemical_formula_sum 'Ca1.6 Co1 Pr0.37 C1.65 Al0.35 O5' _symmetry_cell_setting orthorhombic _symmetry_space_group_name_H-M 'Pnma' _symmetry_space_group_name_Hall ? _cell_length_a 5.2789(5) _cell_length_b 14.998(2) _cell_length_c 5.4868(5) _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_volume 434.41(14) _cell_formula_units_Z 4 _exptl_crystal_density_diffrn 4.63 _exptl_crystal_density_meas ? _exptl_crystal_F_000 572.4 _exptl_absorpt_coefficient_mu 10.25 _diffrn_radiation_type Mo _diffrn_radiation_wavelength 0.71069 loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv Co1 0 0 0 .0086(4) Co2 -.001(2) 0.25 -.0607(4) .0362(9) Al -.0013 0.25 -.0607 ? Ca .0002(6) .10851(6) .4802(2) .0102(3) Pr .0002 .10851 .4802 ? O1 .246(2) -.0122(3) .265(2) .0055(10) O2 -.022(2) .1439(4) .0641(10) .0145(14) O3 -.1036(16) 0.25 .6282(17) .0109(17)