data_global
_amcsd_formula_title 'VO(HPO4)(H2O)2'
loop_
_publ_author_name
'Le Bail A'
'Ferey G'
'Amoros P'
'Beltran Porter D'
'Villeneuve G'
_journal_name_full 'Journal of Solid State Chemistry'
_journal_volume 79 
_journal_year 1989
_journal_page_first 169
_journal_page_last 176
_publ_section_title
;
 Crystal structure of beta-VO(HPO4)(H2O)2 solved from X-Ray powder diffraction
 _cod_database_code 1000072
;
_database_code_amcsd 0013650
_chemical_formula_sum 'V P O7 H5'
_cell_length_a 5.659
_cell_length_b 7.578
_cell_length_c 12.623
_cell_angle_alpha 89.66
_cell_angle_beta 102.14
_cell_angle_gamma 92.23
_cell_volume 528.815
_exptl_crystal_density_diffrn      2.499
_symmetry_space_group_name_H-M 'P -1'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '-x,-y,-z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
V1   0.88600   0.27620   0.36280
V2   0.90870   0.21970   0.86210
P1   0.83100   0.34400   0.61010
P2   0.84700   0.16050   0.10700
O1   0.96300   0.26900   0.71300
O2   0.95800   0.26700   0.21900
O3   0.95900   0.23700   0.02300
O4   0.88200   0.22900   0.50900
O5   0.26500   0.38200   0.90300
O6   0.22400   0.11200   0.40600
O7   0.86000   0.54300   0.59760
O8   0.85800   0.96200   0.12110
O-H1   0.55000   0.31360   0.60300
O-H2   0.54800   0.19700   0.08050
Wat1   0.64600   0.40000   0.33120
Wat2   0.67100   0.09900   0.83640
Wat3   0.72600   0.01900   0.34170
Wat4   0.76500   0.46600   0.86000