data_global
_chemical_name_mineral 'Alluaudite'
loop_
_publ_author_name
'Hatert F'
'Hermann R P'
'Long G J'
'Fransolet A M'
'Grandjean F'
_journal_name_full 'American Mineralogist'
_journal_volume 88 
_journal_year 2003
_journal_page_first 211
_journal_page_last 222
_publ_section_title
;
 An X-ray Rietveld, infrared, and Mossbauer spectral study of the
 NaMn(Fe1-xInx)2(PO4)3 alluaudite-type solid solution
 Sample: x = 0.25, NaMnFe1.5In0.5(PO4)3
;
_database_code_amcsd 0002971
_chemical_formula_sum 'Na.533 Mn.49 In.51 Fe1.5 P2.5 O12'
_cell_length_a 12.064
_cell_length_b 12.641
_cell_length_c 6.428
_cell_angle_alpha 90
_cell_angle_beta 114.63
_cell_angle_gamma 90
_cell_volume 891.089
_exptl_crystal_density_diffrn      3.361
_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
NaA2*   0.00000  -0.03000   0.25000   0.03300   0.01267
NaA1   0.50000   0.00000   0.00000   0.50000   0.04179
MnM1   0.00000   0.26500   0.25000   0.42600   0.00760
InM1   0.00000   0.26500   0.25000   0.07400   0.00760
FeM2   0.28310   0.65200   0.37170   0.75000   0.01013
InM2   0.28310   0.65200   0.37170   0.21800   0.01013
MnM2   0.28310   0.65200   0.37170   0.03200   0.01013
P1   0.00000  -0.28250   0.25000   0.50000   0.00760
P2   0.23750  -0.10860   0.13310   1.00000   0.00760
O1   0.45890   0.72840   0.52900   1.00000   0.00507
O2   0.09690   0.63580   0.23400   1.00000   0.00507
O3   0.32420   0.66090   0.10600   1.00000   0.00507
O4   0.13290   0.39550   0.32700   1.00000   0.00507
O5   0.22390   0.82830   0.31500   1.00000   0.00507
O6   0.31100   0.50120   0.37100   1.00000   0.00507