data_global
_chemical_name_mineral 'Seidozerite'
loop_
_publ_author_name
'Skszat S M'
'Simonov V I'
_journal_name_full 'Soviet Physics Crystallography'
_journal_volume 10 
_journal_year 1966
_journal_page_first 505
_journal_page_last 508
_publ_section_title
;
 The structure of calcium seidozerite
;
_database_code_amcsd 0015550
_chemical_compound_source 'Baikal area, Russia'
_chemical_formula_sum 'Zr1.4 Mn.56 Fe.42 Ti.78 Ca1.28 Na3.56 Si4 O16 F2'
_cell_length_a 5.54
_cell_length_b 7.10
_cell_length_c 18.36
_cell_angle_alpha 90
_cell_angle_beta 102.40
_cell_angle_gamma 90
_cell_volume 705.326
_exptl_crystal_density_diffrn      3.573
_symmetry_space_group_name_H-M 'P 1 2/c 1'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  'x,-y,1/2+z'
  '-x,y,1/2-z'
  '-x,-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
Zr   0.19800   0.11800   0.07390   0.70000   0.01773
Mn   0.19800   0.11800   0.07390   0.20000   0.01773
Fe   0.19800   0.11800   0.07390   0.10000   0.01773
Ti   0.00000   0.10900   0.25000   0.78000   0.01267
Fe   0.00000   0.10900   0.25000   0.22000   0.01267
Ca   0.50000   0.34800   0.25000   0.84000   0.01267
Mn   0.50000   0.34800   0.25000   0.16000   0.01267
NaI   0.20200   0.61100   0.06930   0.78000   0.02026
Ca   0.20200   0.61100   0.06930   0.22000   0.02026
NaII   0.00000   0.60900   0.25000   1.00000   0.01393
NaIII   0.50000   0.85000   0.25000   1.00000   0.01900
SiI   0.72300   0.38500   0.10420   1.00000   0.00887
SiII   0.72200   0.83900   0.10530   1.00000   0.01140
OI   0.73600   0.61100   0.10800   1.00000   0.01900
OII   0.44000   0.31800   0.06500   1.00000   0.01773
OIII   0.44000   0.90300   0.07600   1.00000   0.01140
OIV   0.91900   0.31400   0.05600   1.00000   0.01140
OV   0.90000   0.90900   0.05100   1.00000   0.01267
OVI   0.78700   0.30600   0.18800   1.00000   0.01140
OVII   0.81600   0.91900   0.18700   1.00000   0.01520
OVIII   0.24100   0.12700   0.18300   1.00000   0.02026
F,OH   0.30200   0.57000   0.19100   1.00000   0.00887