data_global _amcsd_formula_title 'Ba Mo2 O12 P2' loop_ _publ_author_name 'Masse R' 'Averbuch-Pouchot M' 'Durif A' _journal_name_full 'Journal of Solid State Chemistry' _journal_volume 58 _journal_year 1985 _journal_page_first 157 _journal_page_last 163 _publ_section_title ; Crystal structures of phosphomolybdyl salts: Pb (Mo O2)2 (PO4)2 and Ba (Mo O2)2 (P O4)2. _cod_database_code 1007171 ; _database_code_amcsd 0013554 _chemical_formula_sum 'Ba Mo2 P2 O12' _cell_length_a 6.383 _cell_length_b 7.142 _cell_length_c 9.953 _cell_angle_alpha 90 _cell_angle_beta 95.46 _cell_angle_gamma 90 _cell_volume 451.673 _exptl_crystal_density_diffrn 4.288 _symmetry_space_group_name_H-M 'P 1 21/c 1' loop_ _space_group_symop_operation_xyz 'x,y,z' 'x,1/2-y,1/2+z' '-x,1/2+y,1/2-z' '-x,-y,-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z Ba1 0.00000 0.00000 0.00000 Mo1 0.27632 0.46559 0.17490 P1 0.23400 0.05150 0.34260 O1 0.04130 0.92400 0.31240 O2 0.21430 0.33740 0.97210 O3 0.25280 0.17470 0.21810 O4 0.57000 0.42260 0.14180 O5 0.67570 0.01770 0.15880 O6 0.76240 0.18130 0.39610