data_global _amcsd_formula_title 'Mo O7 P2' loop_ _publ_author_name 'Leclaire A' 'Borel M' 'Grandin A' 'Raveau B' _journal_name_full 'European Journal of Solid State and Inorganic Chemistry' _journal_volume 25 _journal_year 1988 _journal_page_first 323 _journal_page_last 327 _publ_section_title ; Structure of molybdenum (IV) diphosphate Mo P2 O7 _cod_database_code 1001387 ; _database_code_amcsd 0012520 _chemical_formula_sum 'Mo P2 O7' _cell_length_a 7.944 _cell_length_b 7.944 _cell_length_c 7.944 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_volume 501.323 _exptl_crystal_density_diffrn 3.576 _symmetry_space_group_name_H-M 'P a 3' loop_ _space_group_symop_operation_xyz 'x,y,z' '1/2+z,x,1/2-y' 'z,1/2-x,1/2+y' '1/2-z,1/2+x,y' '-z,-x,-y' '1/2+y,1/2-z,-x' '1/2-y,-z,1/2+x' '-y,1/2+z,1/2-x' 'y,z,x' 'x,1/2-y,1/2+z' '1/2-x,1/2+y,z' '1/2+x,y,1/2-z' '-x,-y,-z' '1/2-z,-x,1/2+y' '-z,1/2+x,1/2-y' '1/2+z,1/2-x,-y' 'z,x,y' '1/2-y,1/2+z,x' '1/2+y,z,1/2-x' 'y,1/2-z,1/2+x' '-y,-z,-x' '-x,1/2+y,1/2-z' '1/2+x,1/2-y,-z' '1/2-x,-y,1/2+z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z Mo1 0.00000 0.00000 0.00000 P1 0.39000 0.39000 0.39000 O1 0.50000 0.50000 0.50000 O2 0.22200 0.07800 -0.05800