data_global
_chemical_name_mineral 'Lausenite'
loop_
_publ_author_name
'Majzlan J'
'Botez C'
'Stephens P W'
_journal_name_full 'American Mineralogist'
_journal_volume 90 
_journal_year 2005
_journal_page_first 411
_journal_page_last 416
_publ_section_title
;
 The crystal structures of synthetics Fe2(SO4)3(H2O)5 and the type specimen of lausenite
;
_database_code_amcsd 0003736
_chemical_compound_source 'Synthetic'
_chemical_formula_sum 'Fe2 S3 O17 H10'
_cell_length_a 10.711
_cell_length_b 11.085
_cell_length_c 5.5747
_cell_angle_alpha 90
_cell_angle_beta 98.853
_cell_angle_gamma 90
_cell_volume 654.007
_exptl_crystal_density_diffrn      2.488
_symmetry_space_group_name_H-M 'P 1 21/m 1'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  'x,1/2-y,z'
  '-x,1/2+y,-z'
  '-x,-y,-z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
Fe1   0.50000   0.50000   0.50000   0.02220
Fe2   0.12620   0.75000   0.89330   0.02220
S1   0.40560   0.75000   0.21630   0.02510
S2   0.22330   0.00200   0.66950   0.02510
O1   0.47290   0.75000   0.00600   0.04570
O2   0.26890   0.75000   0.13900   0.04570
O3   0.36270   0.49280   0.70500   0.04570
O4   0.19020   0.06570   0.87600   0.04570
O5   0.16730   0.03990   0.43000   0.04570
O6   0.42770   0.85290   0.37130   0.04570
O7   0.18550   0.62380   0.70500   0.04570
Wat1   0.39850   0.41470   0.20900   0.04570
Wat2  -0.05180   0.75000   0.68600   0.04570
Wat3   0.05360   0.87280   0.11200   0.04570