data_global
_chemical_name_mineral 'Phlogopite'
loop_
_publ_author_name
'Brigatti M F'
'Medici L'
'Saccani E'
'Vaccaro C'
_journal_name_full 'American Mineralogist'
_journal_volume 81 
_journal_year 1996
_journal_page_first 913
_journal_page_last 927
_publ_section_title
;
 Crystal chemistry and petrologic significance of Fe3+-rich phlogopite from
 the Tapira carbonatite complex, Brazil
 Sample: Tae23-1b
;
_database_code_amcsd 0001816
_chemical_formula_sum 'Si2.84 Al1.12 Fe.34 Ti.09 Mg2.61 K.88 Ba.01 Na.05 O12 H1.82'
_cell_length_a 5.330
_cell_length_b 9.230
_cell_length_c 10.256
_cell_angle_alpha 90
_cell_angle_beta 99.92
_cell_angle_gamma 90
_cell_volume 497.010
_exptl_crystal_density_diffrn      2.856
_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
Si   0.07590   0.16666   0.22784   0.71000
Al   0.07590   0.16666   0.22784   0.28000
Fe   0.07590   0.16666   0.22784   0.01000
Ti   0.00000   0.00000   0.50000   0.03000
Fe   0.00000   0.00000   0.50000   0.10000
Mg   0.00000   0.00000   0.50000   0.87000
Ti   0.00000   0.33250   0.50000   0.03000
Fe   0.00000   0.33250   0.50000   0.10000
Mg   0.00000   0.33250   0.50000   0.87000
K   0.00000   0.50000   0.00000   0.88000
Ba   0.00000   0.50000   0.00000   0.01000
Na   0.00000   0.50000   0.00000   0.05000
O1   0.01120   0.00000   0.17060   1.00000
O2   0.32960   0.22740   0.17070   1.00000
O3   0.13000   0.16680   0.39100   1.00000
O-H4   0.13230   0.50000   0.39760   0.91000
O4   0.13230   0.50000   0.39760   0.09000
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
Si 0.01229 0.01381 0.02740 0.00025 0.00296 0.00000
Al 0.01229 0.01381 0.02740 0.00025 0.00296 0.00000
Fe 0.01229 0.01381 0.02740 0.00025 0.00296 0.00000
Ti 0.01243 0.01381 0.02896 0.00000 0.00376 0.00000
Fe 0.01243 0.01381 0.02896 0.00000 0.00376 0.00000
Mg 0.01243 0.01381 0.02896 0.00000 0.00376 0.00000
Ti 0.01201 0.01467 0.02896 0.00000 0.00269 0.00000
Fe 0.01201 0.01467 0.02896 0.00000 0.00269 0.00000
Mg 0.01201 0.01467 0.02896 0.00000 0.00269 0.00000
K 0.03798 0.04057 0.03826 0.00000 0.00511 0.00000
Ba 0.03798 0.04057 0.03826 0.00000 0.00511 0.00000
Na 0.03798 0.04057 0.03826 0.00000 0.00511 0.00000
O1 0.03156 0.02244 0.03154 0.00000 0.00134 0.00000
O2 0.02458 0.03107 0.03206 -0.00565 0.00484 -0.00283
O3 0.01452 0.01554 0.02792 0.00000 0.00349 0.00000
O-H4 0.01466 0.01683 0.03051 0.00000 0.00403 0.00000
O4 0.01466 0.01683 0.03051 0.00000 0.00403 0.00000