#------------------------------------------------------------------------------ #$Date: 2016-02-14 06:40:26 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176432 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/50/94/1509433.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_1509433 loop_ _publ_author_name 'Maazaz, M.' 'Imaz, I.' 'Chaminade, J.P.' 'Mesnaoui, M.' 'El Masloumi, M.' 'Videau, J.J.' 'Couzi, M.' _publ_section_title ; Synthesis, crystal structure and vibrational spectra characterization of M(I) La (P O3)4 ; _journal_name_full 'Journal of Solid State Chemistry' _journal_page_first 3581 _journal_page_last 3588 _journal_paper_doi 10.1016/j.jssc.2005.09.011 _journal_volume 178 _journal_year 2005 _chemical_formula_sum 'Ag La O12 P4' _chemical_name_systematic 'Ag La (P O3)4' _space_group_IT_number 14 _symmetry_space_group_name_Hall '-P 2yn' _symmetry_space_group_name_H-M 'P 1 21/n 1' _cell_angle_alpha 90 _cell_angle_beta 90.47 _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 7.3001 _cell_length_b 13.2115 _cell_length_c 10.0795 _cell_volume 972.087 _citation_journal_id_ASTM JSSCBI _cod_data_source_file silver1-2_388.cif _cod_data_source_block Ag1La1O12P4 _cod_original_cell_volume 972.0874 _cod_original_sg_symbol_Hall '-P 2ybc (x-z,y,z)' _cod_original_formula_sum 'Ag1 La1 O12 P4' _cod_database_code 1509433 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x+1/2,y+1/2,-z+1/2 -x,-y,-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 Ag1 Ag+1 0.50133 0.27684 0.56809 1 0.0 O11 O-2 0.7092 -0.1023 0.8967 1 0.0 P4 P+5 0.3557 -0.1265 0.6931 1 0.0 O2 O-2 0.0879 0.0785 0.7847 1 0.0 P3 P+5 0.7472 -0.0973 0.7537 1 0.0 O4 O-2 0.8687 0.19 0.6556 1 0.0 O6 O-2 0.7864 0.0149 0.7051 1 0.0 O5 O-2 0.8084 0.1402 0.8956 1 0.0 La1 La+3 0.51324 0.21545 0.97618 1 0.0 O9 O-2 0.3205 -0.1317 0.8359 1 0.0 P2 P+5 0.8809 0.1138 0.7626 1 0.0 O1 O-2 0.2353 0.1569 0.5824 1 0.0 O12 O-2 0.8972 -0.1619 0.7046 1 0.0 O7 O-2 0.2814 -0.0233 0.6316 1 0.0 O10 O-2 0.5689 -0.1201 0.6659 1 0.0 O3 O-2 0.4225 0.1069 0.7858 1 0.0 P1 P+5 0.2668 0.088 0.696 1 0.0 O8 O-2 0.287 -0.2087 0.6053 1 0.0