data_global
_chemical_name_mineral 'Phlogopite'
loop_
_publ_author_name
'Russell R L'
'Guggenheim S'
_journal_name_full 'The Canadian Mineralogist'
_journal_volume 37 
_journal_year 1999
_journal_page_first 711
_journal_page_last 720
_publ_section_title
;
 The crystal structures of near-end-member phlogopite at high temperatures
 and heat-treated Fe-rich phlogopite: The influence of the O, OH, F site
 Sample: T = 450 deg C
;
_database_code_amcsd 0005601
_chemical_compound_source 'White Well, Australia'
_chemical_formula_sum 'K.82 Na.115 Mg2.28 Al1.711 Fe.12 Si2.784 O11.932 (F.068 H1.932)'
_cell_length_a 5.3331
_cell_length_b 9.2316
_cell_length_c 10.3159
_cell_angle_alpha 90
_cell_angle_beta 100.004
_cell_angle_gamma 90
_cell_volume 500.161
_exptl_crystal_density_diffrn      2.758
_symmetry_space_group_name_H-M 'C 1 2/m 1'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '1/2+x,1/2+y,z'
  'x,-y,z'
  '1/2+x,1/2-y,z'
  '-x,y,-z'
  '1/2-x,1/2+y,-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
K   0.00000   0.50000   0.00000   0.82000
Na   0.00000   0.50000   0.00000   0.11500
Mg1   0.00000   0.00000   0.50000   0.76000
Al1   0.00000   0.00000   0.50000   0.16500
Fe1   0.00000   0.00000   0.50000   0.04000
Mg2   0.00000   0.33170   0.50000   0.76000
Al2   0.00000   0.33170   0.50000   0.16500
Fe2   0.00000   0.33170   0.50000   0.04000
Si   0.07680   0.16680   0.22960   0.69600
Al   0.07680   0.16680   0.22960   0.30400
O1   0.01790   0.00000   0.17270   1.00000
O2   0.33730   0.22890   0.17330   1.00000
O3   0.13150   0.16730   0.39330   1.00000
O-H4   0.13200   0.50000   0.39780   0.96600
F4   0.13200   0.50000   0.39780   0.03400
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
K 0.08650 0.09230 0.06890 0.00000 0.01330 0.00000
Na 0.08650 0.09230 0.06890 0.00000 0.01330 0.00000
Mg1 0.01590 0.03000 0.02580 0.00000 0.00430 0.00000
Al1 0.01590 0.03000 0.02580 0.00000 0.00430 0.00000
Fe1 0.01590 0.03000 0.02580 0.00000 0.00430 0.00000
Mg2 0.01570 0.03020 0.02390 0.00000 0.00180 0.00000
Al2 0.01570 0.03020 0.02390 0.00000 0.00180 0.00000
Fe2 0.01570 0.03020 0.02390 0.00000 0.00180 0.00000
Si 0.02060 0.03080 0.02320 0.00030 0.00280 -0.00010
Al 0.02060 0.03080 0.02320 0.00030 0.00280 -0.00010
O1 0.04570 0.02910 0.03820 0.00000 0.00120 0.00000
O2 0.03190 0.04290 0.03980 -0.00900 0.00890 -0.00780
O3 0.02270 0.03500 0.02550 0.00180 0.00220 -0.00110
O-H4 0.03590 0.04730 0.04610 0.00000 0.00460 0.00000
F4 0.03590 0.04730 0.04610 0.00000 0.00460 0.00000