data_global
_chemical_name_mineral 'Phlogopite-1M'
loop_
_publ_author_name
'Schingaro E'
'Scordari F'
'Ventruti G'
_journal_name_full 'European Journal of Mineralogy'
_journal_volume 13 
_journal_year 2001
_journal_page_first 1057
_journal_page_last 1069
_publ_section_title
;
 Trioctahedral micas-1M from Mt. Vulture (Italy): Structural
 disorder and crystal chemistry
 Sample: LC7G
;
_database_code_amcsd 0006918
_chemical_compound_source 'Mt. Vulture, Italy'
_chemical_formula_sum 'K.89 Na.06 Ba.02 Al1.43 Mg2.13 Fe.6 Ti.13 Mn.01 Si2.58 O11.76 (F.24 H1.76)'
_cell_length_a 5.327
_cell_length_b 9.225
_cell_length_c 10.236
_cell_angle_alpha 90
_cell_angle_beta 99.99
_cell_angle_gamma 90
_cell_volume 495.387
_exptl_crystal_density_diffrn      2.926
_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
K   0.00000   0.00000   0.00000   0.89000   0.03320
Na   0.00000   0.00000   0.00000   0.06000   0.03320
Ba   0.00000   0.00000   0.00000   0.02000   0.03320
AlM2   0.00000   0.83410   0.50000   0.00500   0.00910
MgM2   0.00000   0.83410   0.50000   0.78500   0.00910
FeM2   0.00000   0.83410   0.50000   0.14500   0.00910
TiM2   0.00000   0.83410   0.50000   0.06500   0.00910
MnM1   0.00000   0.50000   0.50000   0.01000   0.00860
FeM1   0.00000   0.50000   0.50000   0.31000   0.00860
MgM1   0.00000   0.50000   0.50000   0.56000   0.00860
SiT   0.57540   0.16690   0.22630   0.64500   0.00910
AlT   0.57540   0.16690   0.22630   0.35500   0.00910
O1   0.83200   0.22370   0.16990   1.00000   0.02520
O2   0.50600   0.00000   0.17100   1.00000   0.02540
O3   0.63050   0.16710   0.39230   1.00000   0.00720
O-H   0.13100   0.00000   0.39640   0.88000   0.00990
F   0.13100   0.00000   0.39640   0.12000   0.00990
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 0.03500 0.03300 0.03300 0.00000 0.00700 0.00000
Na 0.03500 0.03300 0.03300 0.00000 0.00700 0.00000
Ba 0.03500 0.03300 0.03300 0.00000 0.00700 0.00000
AlM2 0.00800 0.00800 0.01300 0.00000 0.00240 0.00000
MgM2 0.00800 0.00800 0.01300 0.00000 0.00240 0.00000
FeM2 0.00800 0.00800 0.01300 0.00000 0.00240 0.00000
TiM2 0.00800 0.00800 0.01300 0.00000 0.00240 0.00000
MnM1 0.00800 0.00600 0.01300 0.00000 0.00300 0.00000
FeM1 0.00800 0.00600 0.01300 0.00000 0.00300 0.00000
MgM1 0.00800 0.00600 0.01300 0.00000 0.00300 0.00000
SiT 0.00900 0.00670 0.01400 -0.00020 0.00330 -0.00030
AlT 0.00900 0.00670 0.01400 -0.00020 0.00330 -0.00030
O1 0.02400 0.03100 0.02300 -0.00300 0.00700 -0.00300
O2 0.02900 0.01900 0.02900 0.00000 0.00400 0.00000
O3 0.00800 0.00500 0.01100 -0.00100 0.00400 0.00000
O-H 0.01200 0.01000 0.00800 0.00000 0.00200 0.00000
F 0.01200 0.01000 0.00800 0.00000 0.00200 0.00000