data_global _amcsd_formula_title 'Na3(MoO)4(PO4)5' loop_ _publ_author_name 'Leclaire A' 'Hoareau T' 'Borel M' 'Grandin A' 'Raveau B' _journal_name_full 'Journal of Solid State Chemistry' _journal_volume 114 _journal_year 1995 _journal_page_first 543 _journal_page_last 549 _publ_section_title ; A sodium Mo(V) monophosphate with a tunnel structure: Na3(MoO)4(PO4)5 _cod_database_code 1001643 ; _database_code_amcsd 0013838 _chemical_formula_sum 'Mo4 P5 Na3 O24' _cell_length_a 16.78899 _cell_length_b 8.500 _cell_length_c 16.36099 _cell_angle_alpha 90 _cell_angle_beta 126.34 _cell_angle_gamma 90 _cell_volume 1880.731 _exptl_crystal_density_diffrn 3.502 _symmetry_space_group_name_H-M 'C 1 2/c 1' loop_ _space_group_symop_operation_xyz 'x,y,z' '1/2+x,1/2+y,z' 'x,-y,1/2+z' '1/2+x,1/2-y,1/2+z' '-x,y,1/2-z' '1/2-x,1/2+y,1/2-z' '-x,-y,-z' '1/2-x,1/2-y,-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Mo1 0.13119 0.05912 0.98397 1.00000 Mo2 0.09579 0.43449 0.18077 1.00000 P1 0.54982 0.25494 0.04157 1.00000 P2 0.36614 0.07679 0.10400 1.00000 P3 0.00000 0.14788 0.25000 1.00000 Na1 0.35650 0.34470 0.23134 1.00000 Na2 0.23080 0.22420 0.42570 0.50000 O1 0.17950 0.13080 0.09840 1.00000 O2 0.14381 0.24590 0.91727 1.00000 O3 0.11417 0.83550 0.01562 1.00000 O4 0.98761 0.11880 0.91997 1.00000 O5 0.26786 -0.00800 0.02360 1.00000 O6 0.07523 -0.04260 0.83912 1.00000 O7 0.21406 0.38440 0.23630 1.00000 O8 0.03872 0.32850 0.04909 1.00000 O9 0.06040 0.24820 0.22790 1.00000 O10 0.11531 0.57000 0.29214 1.00000 O11 0.11499 0.64010 0.12883 1.00000 O12 0.94694 0.50270 0.10368 1.00000