#------------------------------------------------------------------------------ #$Date: 2012-02-24 17:13:23 +0000 (Fri, 24 Feb 2012) $ #$Revision: 34330 $ #$URL: svn://www.crystallography.net/cod/cif/4/00/04/4000478.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_4000478 _journal_name_full 'Chemistry of Materials' _journal_year 2004 _chemical_formula_sum "Ga0.35 Ge0.15 La O2.32" _chemical_formula_weight 211.32 _cell_formula_units_Z 16 _symmetry_cell_setting monoclinic _symmetry_space_group_name_H-M 'P 1 21/c 1' loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 +x,+y,+z 2 -x,+y+1/2,-z+1/2 -1 -x,-y,-z -2 +x,-y+1/2,+z+1/2 _cell_length_a 8.00967(15) _cell_length_b 11.16007(23) _cell_length_c 11.6426(4) _cell_angle_alpha 90.0 _cell_angle_beta 110.106(4) _cell_angle_gamma 90.0 _cell_volume 977.28723 loop_ _atom_site_type_symbol _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy _atom_site_thermal_displace_type _atom_site_U_iso_or_equiv _atom_site_symmetry_multiplicity GA Ga1 0.1525(9) 0.1936(7) 0.1236(8) 0.7 Uiso 0.0065(20) 4 GA Ga2 0.6789(11) 0.1946(7) 0.1295(7) 0.7 Uiso 0.0094(20) 4 LA La1 0.5295(11) 0.0831(5) 0.8061(5) 1.0 Uiso 0.0056(14) 4 LA La2 0.0293(10) 0.0937(5) 0.7925(5) 1.0 Uiso 0.0091(15) 4 LA La3 0.3366(10) 0.1254(8) 0.4273(5) 1.0 Uiso 0.0031(17) 4 LA La4 0.8376(10) 0.1253(8) 0.4219(5) 1.0 Uiso 0.0038(16) 4 O O1 0.7602(17) 0.2155(16) 0.7611(10) 1.0 Uiso 0.0132(26) 4 O O2 0.2658(18) 0.2140(17) 0.7588(12) 1.0 Uiso 0.0250(30) 4 O O3 0.2147(20) 0.0423(10) 0.1862(9) 1.0 Uiso 0.0205(34) 4 O O4 0.0858(16) 0.2298(11) 0.9719(12) 1.0 Uiso 0.0217(34) 4 O O5 0.4334(24) 0.2451(13) 0.1142(12) 0.691(23) Uiso 0.0129(19) 4 O O6 0.6349(14) 0.2339(10) 0.9706(10) 1.0 Uiso 0.0019(26) 4 O O7 0.7072(17) 0.0398(9) 0.1678(7) 1.0 Uiso 0.0077(27) 4 O O8 0.0736(15) 0.0027(9) 0.4019(9) 1.0 Uiso 0.0023(24) 4 O O9 0.5738(15) 0.0051(8) 0.3909(9) 1.0 Uiso 0.0018(26) 4 GE Ge1 0.1525(9) 0.1936(7) 0.1236(8) 0.3 Uiso 0.0065(20) 4 GE Ge2 0.6789(11) 0.1946(7) 0.1295(7) 0.3 Uiso 0.0094(20) 4 O O10 0.0635(31) 0.7403(16) 0.3700(14) 0.589(22) Uiso 0.0129(19) 4 _cod_database_code 4000478