data_global
_amcsd_formula_title 'Cs(MoO)P2O7'
loop_
_publ_author_name
'Guesdon A'
'Borel M'
'Leclaire A'
'Grandin A'
'Raveau B'
_journal_name_full 'Journal of Solid State Chemistry'
_journal_volume 108 
_journal_year 1994
_journal_page_first 46
_journal_page_last 50
_publ_section_title
;
 A molybdenum (V) diphosphate closely related to the alpha-NaTiP2O7 structure:
 Cs(MoO)P2O7
 _cod_database_code 1001618
;
_database_code_amcsd 0013789
_chemical_formula_sum 'Mo Cs P2 O8'
_cell_length_a 5.1340
_cell_length_b 11.707
_cell_length_c 12.063
_cell_angle_alpha 90
_cell_angle_beta 91.77
_cell_angle_gamma 90
_cell_volume 724.685
_exptl_crystal_density_diffrn      3.838
_symmetry_space_group_name_H-M 'P 1 21/n 1'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '1/2+x,1/2-y,1/2+z'
  '1/2-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
Mo1   0.23650   0.04536   0.18973
Cs1   0.76880   0.33667   0.05123
P1   0.76460   0.16680   0.31010
P2   0.77810   0.39720   0.41850
O1   0.23800  -0.03620   0.30290
O2   0.02600   0.17500   0.25420
O3   0.55100   0.13790   0.22330
O4  -0.09700  -0.00830   0.11640
O5   0.44000  -0.07170   0.10000
O6   0.24700   0.14550   0.03390
O7   0.76300   0.09890   0.41190
O8   0.69900   0.29860   0.33410