data_global
_chemical_name_mineral 'Lipscombite'
loop_
_publ_author_name
'Vencato I'
'Mattievich E'
'Mascarenhas Y P'
_journal_name_full 'American Mineralogist'
_journal_volume 74 
_journal_year 1989
_journal_page_first 456
_journal_page_last 460
_publ_section_title
;
 Crystal structure of synthetic lipscombite: A redetermination
;
_database_code_amcsd 0001230
_chemical_formula_sum 'Fe1.473 P O5 H'
_cell_length_a 7.310
_cell_length_b 7.310
_cell_length_c 13.212
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 90
_cell_volume 705.998
_exptl_crystal_density_diffrn      3.655
_symmetry_space_group_name_H-M 'P 43 21 2'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  'y,x,-z'
  '1/2-y,1/2+x,3/4+z'
  '1/2-x,1/2+y,3/4-z'
  '-x,-y,1/2+z'
  '-y,-x,1/2-z'
  '1/2+y,1/2-x,1/4+z'
  '1/2+x,1/2-y,1/4-z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
Fe1   0.36800   0.36800   0.00000   0.78200
Fe2   0.13800   0.13800   0.50000   0.16400
Fe3   0.14890   0.38210   0.24580   1.00000
P   0.25700   0.00000   0.12400   1.00000
O1   0.38600   0.01120   0.05300   1.00000
O2   0.13400   0.12900   0.18400   1.00000
O3   0.13800  -0.13200   0.06200   1.00000
O4   0.37200  -0.11300   0.19300   1.00000
O-H   0.01200   0.23500   0.37300   1.00000
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
Fe1 0.04600 0.04600 0.01600 -0.02600 -0.00200 0.00200
Fe2 0.03100 0.03100 0.03800 -0.01700 -0.02700 0.02700
Fe3 0.00060 0.00800 0.03000 0.00000 0.00000 0.00000
P 0.02100 0.00700 0.01700 0.00300 0.00500 0.01000
O1 0.02800 0.02100 0.03400 0.00700 0.01000 -0.01200
O2 0.02900 0.01400 0.03700 -0.00500 0.00900 -0.00200
O3 0.04600 0.03600 0.04800 0.00000 -0.00600 0.00100
O4 0.02800 0.02900 0.03200 -0.00400 -0.01500 0.00200
O-H 0.01500 0.01500 0.01000 -0.00200 0.00400 0.00500