data_global
_chemical_name_mineral 'Phlogopite'
loop_
_publ_author_name
'Brigatti M F'
'Poppi L'
_journal_name_full 'European Journal of Mineralogy'
_journal_volume 5 
_journal_year 1993
_journal_page_first 857
_journal_page_last 871
_publ_section_title
;
 Crystal chemistry of Ba-rich trioctahedral micas-1M
 Sample: 25
;
_database_code_amcsd 0006501
_chemical_formula_sum 'O11.742 F.258 (K.885 Ba.115) Al1.655 Fe.999 Mg1.58 Mn.007 Ti.171 Si2.587 H1.218'
_cell_length_a 5.333
_cell_length_b 9.241
_cell_length_c 10.180
_cell_angle_alpha 90
_cell_angle_beta 100.10
_cell_angle_gamma 90
_cell_volume 493.919
_exptl_crystal_density_diffrn      3.123
_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
_atom_site_U_iso_or_equiv
O1   0.01190   0.00000   0.16730   1.00000   0.02672
O2   0.32720   0.22820   0.16660   1.00000   0.02685
O3   0.13080   0.16750   0.39100   1.00000   0.01849
O-H4   0.13170   0.50000   0.39840   0.60880   0.01811
F4   0.13170   0.50000   0.39840   0.12900   0.01811
O4   0.13170   0.50000   0.39840   0.26220   0.01811
K   0.00000   0.50000   0.00000   0.88460   0.03445
Ba   0.00000   0.50000   0.00000   0.11540   0.03445
AlM2   0.00000   0.33560   0.50000   0.08080   0.01900
FeM2   0.00000   0.33560   0.50000   0.33300   0.01900
MgM2   0.00000   0.33560   0.50000   0.52680   0.01900
MnM2   0.00000   0.33560   0.50000   0.00230   0.01900
TiM2   0.00000   0.33560   0.50000   0.05700   0.01900
AlM1   0.00000   0.00000   0.50000   0.08080   0.01558
FeM1   0.00000   0.00000   0.50000   0.33300   0.01558
MgM1   0.00000   0.00000   0.50000   0.52680   0.01558
MnM1   0.00000   0.00000   0.50000   0.00230   0.01558
TiM1   0.00000   0.00000   0.50000   0.05700   0.01558
SiT   0.07480   0.16690   0.22460   0.64680   0.01507
AlT   0.07480   0.16690   0.22460   0.35320   0.01507
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
O1 0.03631 0.02033 0.02239 0.00000 0.00240 0.00000
O2 0.02765 0.03158 0.02239 -0.00664 0.00693 -0.00282
O3 0.01969 0.01817 0.01832 0.00025 0.00400 0.00000
O-H4 0.01871 0.01904 0.01679 0.00000 0.00373 0.00000
F4 0.01871 0.01904 0.01679 0.00000 0.00373 0.00000
O4 0.01871 0.01904 0.01679 0.00000 0.00373 0.00000
K 0.03505 0.03245 0.03613 0.00000 0.00773 0.00000
Ba 0.03505 0.03245 0.03613 0.00000 0.00773 0.00000
AlM2 0.01718 0.01947 0.02035 0.00000 0.00400 0.00000
FeM2 0.01718 0.01947 0.02035 0.00000 0.00400 0.00000
MgM2 0.01718 0.01947 0.02035 0.00000 0.00400 0.00000
MnM2 0.01718 0.01947 0.02035 0.00000 0.00400 0.00000
TiM2 0.01718 0.01947 0.02035 0.00000 0.00400 0.00000
AlM1 0.01634 0.01211 0.01934 0.00000 0.00613 0.00000
FeM1 0.01634 0.01211 0.01934 0.00000 0.00613 0.00000
MgM1 0.01634 0.01211 0.01934 0.00000 0.00613 0.00000
MnM1 0.01634 0.01211 0.01934 0.00000 0.00613 0.00000
TiM1 0.01634 0.01211 0.01934 0.00000 0.00613 0.00000
SiT 0.01620 0.01384 0.01577 0.00000 0.00373 0.00000
AlT 0.01620 0.01384 0.01577 0.00000 0.00373 0.00000