data_global
_amcsd_formula_title 'Co(VO)2(PO4)2*4H2O'
loop_
_publ_author_name
'Kang H Y'
'Lee W C'
'Wang S L'
_journal_name_full 'Inorganic Chemistry'
_journal_volume 31 
_journal_year 1992
_journal_page_first 4743
_journal_page_last 4748
_publ_section_title
;
 Hydrothermal synthesis and structural characterization of four layered
 vanadyl(IV) phosphate hydrates A(VO)2(PO4)2*4H2O (A=Co,Ca,Sr,Pb)
;
_database_code_amcsd 0012704
_chemical_compound_source 'Synthetic'
_chemical_formula_sum 'Co V2 P2 O14'
_cell_length_a 6.264
_cell_length_b 6.264
_cell_length_c 13.428
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 90
_cell_volume 526.884
_exptl_crystal_density_diffrn      2.816
_symmetry_space_group_name_H-M 'I 4/m m m'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '1/2+x,1/2+y,1/2+z'
  '-y,-x,z'
  '1/2-y,1/2-x,1/2+z'
  'y,x,-z'
  '1/2+y,1/2+x,1/2-z'
  'y,-x,-z'
  '1/2+y,1/2-x,1/2-z'
  '-y,x,z'
  '1/2-y,1/2+x,1/2+z'
  'x,-y,z'
  '1/2+x,1/2-y,1/2+z'
  '-x,y,-z'
  '1/2-x,1/2+y,1/2-z'
  'x,y,-z'
  '1/2+x,1/2+y,1/2-z'
  '-x,-y,z'
  '1/2-x,1/2-y,1/2+z'
  'y,x,z'
  '1/2+y,1/2+x,1/2+z'
  '-y,-x,-z'
  '1/2-y,1/2-x,1/2-z'
  '-y,x,-z'
  '1/2-y,1/2+x,1/2-z'
  'y,-x,z'
  '1/2+y,1/2-x,1/2+z'
  '-x,y,z'
  '1/2-x,1/2+y,1/2+z'
  'x,-y,-z'
  '1/2+x,1/2-y,1/2-z'
  '-x,-y,-z'
  '1/2-x,1/2-y,1/2-z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_U_iso_or_equiv
Co   0.50000   0.50000   0.00000   1.00000   0.01300
V   0.50000   0.50000   0.72190   1.00000   0.00600
P   0.00000   0.50000   0.75000   1.00000   0.00600
O1   0.50000   0.50000   0.84100   1.00000   0.01800
O2   0.80300   0.50000   0.68240   1.00000   0.01800
O3   0.78200   0.68400   0.00000   0.50000   0.03000
loop_
_atom_site_aniso_label
_atom_site_aniso_U_11
_atom_site_aniso_U_22
_atom_site_aniso_U_33
_atom_site_aniso_U_12
_atom_site_aniso_U_13
_atom_site_aniso_U_23
Co 0.01400 0.01400 0.01100 0.00000 0.00000 0.00000
V 0.00500 0.00500 0.00700 0.00000 0.00000 0.00000
P 0.00500 0.00500 0.00800 0.00000 0.00000 0.00000
O1 0.02000 0.02000 0.01400 0.00000 0.00000 0.00000
O2 0.01200 0.03300 0.01000 0.00000 -0.00100 0.00000
O3 0.02700 0.04200 0.02100 -0.01100 0.00000 0.00000