data_global
_chemical_name_mineral 'Lepidocrocite'
loop_
_publ_author_name
'Zhukhlistov A P'
_journal_name_full 'Crystallography Reports'
_journal_volume 46 
_journal_year 2001
_journal_page_first 730
_journal_page_last 733
_publ_section_title
;
 Crystal structure of lepidocrocite FeO(OH) from the electron-diffractometry data
;
_database_code_amcsd 0020690
_chemical_compound_source 'natural but not given'
_chemical_formula_sum 'Fe O2 H'
_cell_length_a 3.072
_cell_length_b 12.516
_cell_length_c 3.873
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 90
_cell_volume 148.914
_exptl_crystal_density_diffrn      3.963
_symmetry_space_group_name_H-M 'C m c m'
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'
  '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
Fe   0.50000   0.17780   0.25000   1.00000
O1   0.00000   0.28890   0.25000   1.00000
O2   0.00000   0.07380   0.25000   1.00000
H   0.00000  -0.00100   0.17900   0.50000
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
Fe 0.00296 0.01190 0.00965 0.00000 0.00000 0.00000
O1 0.00516 0.01746 0.00851 0.00000 0.00000 0.00000
O2 0.00502 0.01905 0.01611 0.00000 0.00000 0.00000
H 0.01721 0.02381 0.02280 0.00000 0.00000 -0.00123