data_global
_amcsd_formula_title 'Cs Mo8 O33 P4'
loop_
_publ_author_name
'Hoareau T'
'Leclaire A'
'Borel M'
'Provost J'
'Raveau B'
_journal_name_full 'Journal of Solid State Chemistry'
_journal_volume 128 
_journal_year 1997
_journal_page_first 233
_journal_page_last 240
_publ_section_title
;
 A mixed valent molybdenum monophosphate with an original cage structure
 Cs Mo6 O10 (Mo2 O7) (P O4)4
 _cod_database_code 1001806
;
_database_code_amcsd 0013917
_chemical_formula_sum 'Mo4 Cs.5 P2 O16.5'
_cell_length_a 9.953
_cell_length_b 9.953
_cell_length_c 26.41299
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 90
_cell_volume 2616.529
_exptl_crystal_density_diffrn      3.941
_symmetry_space_group_name_H-M 'I -4 2 d'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '1/2+x,1/2+y,1/2+z'
  '1/2-y,-x,3/4+z'
  '-y,1/2-x,1/4+z'
  'y,-x,-z'
  '1/2+y,1/2-x,1/2-z'
  '-x,1/2+y,1/4-z'
  '1/2-x,+y,3/4-z'
  '-x,-y,z'
  '1/2-x,1/2-y,1/2+z'
  '1/2+y,x,3/4+z'
  '+y,1/2+x,1/4+z'
  '-y,x,-z'
  '1/2-y,1/2+x,1/2-z'
  'x,1/2-y,1/4-z'
  '1/2+x,-y,3/4-z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
Mo1   0.18090   0.18470   0.00729   1.00000
Mo2   0.47850   0.50400   0.10915   0.50000
Mo3   0.14120   0.62370   0.11410   0.50000
Cs1   0.00000   0.50000   0.09897   0.50000
P1   0.49050   0.21920   0.04200   1.00000
O1   0.00200   0.18240  -0.01260   1.00000
O2   0.16900   0.22600   0.06840   1.00000
O3   0.19800   0.37400  -0.02130   1.00000
O4   0.38500   0.18000   0.00290   1.00000
O5   0.21500   0.13100  -0.07540   1.00000
O6   0.47000   0.36600   0.05740   1.00000
O7   0.30500   0.54500   0.11010   1.00000
O8   0.53200   0.63300   0.16060   1.00000
O9   0.00000   0.50000   0.09897   0.50000