data_global
_chemical_name_mineral 'Iriginite'
loop_
_publ_author_name
'Krivovichev S V'
'Burns P C'
_journal_name_full 'The Canadian Mineralogist'
_journal_volume 38 
_journal_year 2000
_journal_page_first 847
_journal_page_last 851
_publ_section_title
;
 The crystal chemistry of uranyl molybdates. II. the crystal structure
 of iriginite
;
_database_code_amcsd 0005691
_chemical_formula_sum 'U Mo2 O12 H6'
_cell_length_a 6.705
_cell_length_b 12.731
_cell_length_c 11.524
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 90
_cell_volume 983.704
_exptl_crystal_density_diffrn      4.240
_symmetry_space_group_name_H-M 'P b c m'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  'x,1/2-y,1/2+z'
  '-x,1/2+y,1/2-z'
  '-x,1/2+y,z'
  'x,1/2-y,-z'
  'x,y,1/2-z'
  '-x,-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_U_iso_or_equiv
U   0.70160   0.49398   0.25000   0.01570
Mo   0.16840   0.46925   0.09234   0.01840
O(1)   0.68800   0.35400   0.25000   0.03300
O(2)   0.70600   0.63300   0.25000   0.03400
O(3)   0.41500   0.49750   0.12660   0.02800
O(4)   0.14600   0.50980  -0.06440   0.01900
O(5)   0.05500   0.48000   0.25000   0.02800
Wat(6)   0.14000   0.65560   0.12120   0.02600
O(7)   0.16900   0.33690   0.08190   0.03200
Wat(8)   0.44800   0.75000   0.00000   0.05000
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
U 0.01380 0.02470 0.00850 -0.00050 0.00000 0.00000
Mo 0.01380 0.03290 0.00850 0.00210 0.00050 -0.00030
O(1) 0.04300 0.02100 0.03500 -0.00200 0.00000 0.00000
O(2) 0.03900 0.01600 0.04700 0.00100 0.00000 0.00000
O(3) 0.01900 0.04900 0.01700 0.00000 0.00900 0.00200
O(4) 0.01700 0.02700 0.01300 0.00000 0.00700 0.00500
O(5) 0.02700 0.04600 0.01000 -0.00600 0.00000 0.00000
Wat(6) 0.04100 0.01600 0.02100 -0.00700 0.00100 0.00000
O(7) 0.04600 0.03100 0.01900 0.00800 0.00200 -0.00800
Wat(8) 0.02900 0.04100 0.08000 0.00000 0.00000 0.01500