data_global
_amcsd_formula_title 'Mn0.75K0.5SU2O13H6'
loop_
_publ_author_name
'Peeters O M'
'Vochten R'
'Blaton N'
_journal_name_full 'The Canadian Mineralogist'
_journal_volume 46 
_journal_year 2008
_journal_page_first 173
_journal_page_last 182
_publ_section_title
;
 The crystal structures of synthetic potassium - transition-metal zippeite-group phases
 Sample: K-Mn
;
_database_code_amcsd 0006164
_chemical_formula_sum 'K.778 Mn1.216 U4 S2 O25.94 H11.88'
_cell_length_a 8.661
_cell_length_b 14.375
_cell_length_c 17.705
_cell_angle_alpha 90
_cell_angle_beta 104.12
_cell_angle_gamma 90
_cell_volume 2137.707
_exptl_crystal_density_diffrn      4.786
_symmetry_space_group_name_H-M 'C 1 2/c 1'
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'
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
K   0.20130   0.25080   0.40490   0.38900 337.00000
Mn1   0.95120   0.25060   0.37572   0.48400   0.01520
Mn2   0.50000   0.25010   0.25000   0.24800   0.01020
U1   0.41820   0.01872   0.33547   1.00000   0.00760
U2   0.91460  -0.01879   0.33410   1.00000   0.00490
S   0.74730   0.00300   0.49890   1.00000   0.01110
O1   0.41930   0.14440   0.31790   1.00000   0.01820
O1*   0.43330  -0.10560   0.35750   1.00000   0.01140
O2   0.93970   0.10120   0.37000   1.00000   0.01020
O2*   0.88960  -0.14150   0.31500   1.00000   0.00380
O3   0.64690  -0.00670   0.29320   1.00000   0.01330
O4   0.14750  -0.00640   0.29570   1.00000   0.00440
O5   0.81420  -0.05910   0.45420   1.00000   0.01710
O6   0.67300  -0.05600   0.55240   1.00000   0.01240
O7   0.62150   0.05950   0.45460   1.00000   0.01410
O8   0.86380   0.06790   0.55390   1.00000   0.00830
Wat9   0.70720   0.24940   0.33540   1.00000   0.03180
Wat10   0.20060   0.24230   0.42920   0.70000   0.02500
Wat11   0.94980   0.25460   0.49670   1.00000   0.03240
Wat12   0.00000   0.25000   0.25000   0.54000   0.04600