data_global
_chemical_name_mineral 'Lawsonbauerite'
loop_
_publ_author_name
'Treiman A H'
'Peacor D R'
_journal_name_full 'American Mineralogist'
_journal_volume 67 
_journal_year 1982
_journal_page_first 1029
_journal_page_last 1034
_publ_section_title
;
 The crystal structure of lawsonbauerite, (Mn,Mg)9Zn4(SO4)2(OH)22.8H2O,
 and its relation to mooreite
;
_database_code_amcsd 0000882
_chemical_formula_sum '(Mn6.19 Mg2.81) Zn4 (O38 S2) H30'
_cell_length_a 10.50
_cell_length_b 9.64
_cell_length_c 16.41
_cell_angle_alpha 90
_cell_angle_beta 95.21
_cell_angle_gamma 90
_cell_volume 1654.158
_exptl_crystal_density_diffrn      2.755
_symmetry_space_group_name_H-M 'P 1 21/c 1'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  'x,1/2-y,1/2+z'
  '-x,1/2+y,1/2-z'
  '-x,-y,-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
Mn1   0.00000   0.00000   0.00000   0.71000   0.01697
Mn2   0.15510   0.33400   0.99990   0.62000   0.01811
Mn3   0.01230   0.16760   0.16880   0.68000   0.01773
Mn4   0.00250   0.49980   0.16720   0.70000   0.01710
Mn5   0.50210   0.45820   0.30060   0.74000   0.01722
Mg1   0.00000   0.00000   0.00000   0.29000   0.01697
Mg2   0.15510   0.33400   0.99990   0.38000   0.01811
Mg3   0.01230   0.16760   0.16880   0.32000   0.01773
Mg4   0.00250   0.49980   0.16720   0.30000   0.01710
Mg5   0.50210   0.45820   0.30060   0.26000   0.01722
Zn1   0.18280   0.33550   0.34660   1.00000   0.01760
Zn2   0.83720   0.33290   0.32370   1.00000   0.01849
O-H1   0.10600   0.16020   0.06110   1.00000   0.02381
O-H2   0.10290   0.50770   0.06130   1.00000   0.02672
O-H3   0.11820   0.00370   0.23030   1.00000   0.02166
O-H4   0.12700   0.33510   0.22900   1.00000   0.02406
O-H5   0.11640   0.50670   0.39510   1.00000   0.02267
O-H6   0.12900   0.15940   0.39650   1.00000   0.01912
O-H7   0.91360   0.33140   0.10800   1.00000   0.02026
O-H8   0.89640   0.16460   0.26900   1.00000   0.02356
O-H9   0.89430   0.33210   0.44040   1.00000   0.02128
O-H10   0.37140   0.32690   0.35360   1.00000   0.02406
O-H11   0.64810   0.30830   0.30700   1.00000   0.02064
O-H12   0.38950   0.39660   0.17330   1.00000   0.03217
O-H13   0.62500   0.12840   0.19390   1.00000   0.03584
O-H14   0.39500   0.04190   0.08250   1.00000   0.03116
O-H15   0.38500   0.07230   0.28700   1.00000   0.02736
S   0.59730   0.31480   0.01380   1.00000   0.02001
O16   0.62500   0.12600   0.43500   1.00000   0.03052
O17   0.66560   0.18040   0.02400   1.00000   0.02723
O18   0.64530   0.40740   0.01830   1.00000   0.03318
O19   0.45860   0.28880   0.01640   1.00000   0.02837