data_global
_chemical_name_mineral 'Hagendorfite'
loop_
_publ_author_name
'Redhammer G J'
'Tippelt G'
'Bernroider M'
'Lottermoser W'
'Amthauer G'
'Roth G'
_journal_name_full 'European Journal of Mineralogy'
_journal_volume 17 
_journal_year 2005
_journal_page_first 915
_journal_page_last 932
_publ_section_title
;
 Hagendorfite (Na,Ca)MnFe2(PO4)3 from type locality Hagendorf (Bavaria, Germany):
 Crystal structure determination and 57Fe Mossbauer spectroscopy
 Note: alluaudite structure
 Sample: T = 298 K
;
_database_code_amcsd 0007138
_chemical_compound_source 'Hagendorf, Bavaria, Germany'
_chemical_formula_sum 'Na1.83 Ca.17 Mn Fe2 P3 O12'
_cell_length_a 11.9721
_cell_length_b 12.5988
_cell_length_c 6.5029
_cell_angle_alpha 90
_cell_angle_beta 114.841
_cell_angle_gamma 90
_cell_volume 890.107
_exptl_crystal_density_diffrn      3.734
_symmetry_space_group_name_H-M 'C 1 2/c 1'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '1/2+x,1/2+y,z'
  'x,-y,1/2+z'
  '1/2+x,1/2-y,1/2+z'
  '-x,y,1/2-z'
  '1/2-x,1/2+y,1/2-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
NaA1   0.50000   0.00000   0.00000   0.83000   0.05200
CaA1   0.50000   0.00000   0.00000   0.17000   0.05200
NaA2*   0.00000  -0.01920   0.25000   1.00000   0.03590
MnM1   0.00000   0.26700   0.25000   1.00000   0.01490
FeM2   0.27880   0.65770   0.36450   1.00000   0.01250
P1   0.00000  -0.28810   0.25000   1.00000   0.01280
P2   0.23480  -0.10800   0.12760   1.00000   0.01330
O1   0.45550   0.71800   0.53760   1.00000   0.01590
O2   0.09830   0.63600   0.24090   1.00000   0.02250
O3   0.33570   0.66400   0.10250   1.00000   0.01820
O4   0.12840   0.40330   0.32010   1.00000   0.02090
O5   0.22370   0.82420   0.31430   1.00000   0.01940
O6   0.32730   0.50000   0.38480   1.00000   0.02090