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: Tag15-3
;
_database_code_amcsd 0001813
_chemical_formula_sum '(Si2.76 Al1.24) Ti.12 Fe.6 Mg2.19 K.92 Ba.02 O11.94 F.06 H1.92'
_cell_length_a 5.329
_cell_length_b 9.228
_cell_length_c 10.258
_cell_angle_alpha 90
_cell_angle_beta 100.03
_cell_angle_gamma 90
_cell_volume 496.738
_exptl_crystal_density_diffrn      2.917
_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   0.07600   0.16660   0.22710   0.69000
Al   0.07600   0.16660   0.22710   0.31000
Ti1   0.00000   0.00000   0.50000   0.04000
Fe1   0.00000   0.00000   0.50000   0.20000
Mg1   0.00000   0.00000   0.50000   0.73000
Ti2   0.00000   0.33350   0.50000   0.04000
Fe2   0.00000   0.33350   0.50000   0.20000
Mg2   0.00000   0.33350   0.50000   0.73000
K   0.00000   0.50000   0.00000   0.92000
Ba   0.00000   0.50000   0.00000   0.02000
O1   0.01500   0.00000   0.16990   1.00000
O2   0.32830   0.22780   0.16980   1.00000
O3   0.12950   0.16740   0.39080   1.00000
O-H4   0.13080   0.50000   0.39660   0.96000
F4   0.13080   0.50000   0.39660   0.03000
O4   0.13080   0.50000   0.39660   0.01000
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 0.02316 0.02243 0.02585 0.00049 0.00859 0.00000
Al 0.02316 0.02243 0.02585 0.00049 0.00859 0.00000
Ti1 0.02093 0.01984 0.02585 0.00000 0.00994 0.00000
Fe1 0.02093 0.01984 0.02585 0.00000 0.00994 0.00000
Mg1 0.02093 0.01984 0.02585 0.00000 0.00994 0.00000
Ti2 0.01981 0.02071 0.02481 0.00000 0.00994 0.00000
Fe2 0.01981 0.02071 0.02481 0.00000 0.00994 0.00000
Mg2 0.01981 0.02071 0.02481 0.00000 0.00994 0.00000
K 0.03906 0.04271 0.03567 0.00000 0.01504 0.00000
Ba 0.03906 0.04271 0.03567 0.00000 0.01504 0.00000
O1 0.04325 0.02804 0.03050 0.00000 0.00269 0.00000
O2 0.03348 0.03710 0.03308 -0.00859 0.01611 -0.00189
O3 0.02651 0.02545 0.02223 0.00172 0.00510 0.00047
O-H4 0.02232 0.02761 0.02171 0.00000 0.00806 0.00000
F4 0.02232 0.02761 0.02171 0.00000 0.00806 0.00000
O4 0.02232 0.02761 0.02171 0.00000 0.00806 0.00000