# generated using pymatgen
data_Fe(PO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.53094352
_cell_length_b   8.53094352
_cell_length_c   9.59821668
_cell_angle_alpha   61.10125377
_cell_angle_beta   61.10125377
_cell_angle_gamma   51.46714876
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe(PO3)4
_chemical_formula_sum   'Fe2 P8 O24'
_cell_volume   461.13942369
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Fe  Fe0  1  0.86455300  0.13544700  0.25000000  1.0
  Fe  Fe1  1  0.13544700  0.86455300  0.75000000  1.0
  P  P2  1  0.43598300  0.29669400  0.14507300  1.0
  P  P3  1  0.03426000  0.69846500  0.16515800  1.0
  P  P4  1  0.29669400  0.43598300  0.64507300  1.0
  P  P5  1  0.70330600  0.56401700  0.35492700  1.0
  P  P6  1  0.69846500  0.03426000  0.66515800  1.0
  P  P7  1  0.30153500  0.96574000  0.33484200  1.0
  P  P8  1  0.56401700  0.70330600  0.85492700  1.0
  P  P9  1  0.96574000  0.30153500  0.83484200  1.0
  O  O10  1  0.19811000  0.60083900  0.72794900  1.0
  O  O11  1  0.04209900  0.73624300  0.99229900  1.0
  O  O12  1  0.13491200  0.99496900  0.29491300  1.0
  O  O13  1  0.86508800  0.00503100  0.70508700  1.0
  O  O14  1  0.26375700  0.95790100  0.50770100  1.0
  O  O15  1  0.50214400  0.64497800  0.03920700  1.0
  O  O16  1  0.34924300  0.14739600  0.20551300  1.0
  O  O17  1  0.00503100  0.86508800  0.20508700  1.0
  O  O18  1  0.64497800  0.50214400  0.53920700  1.0
  O  O19  1  0.49785600  0.35502200  0.96079300  1.0
  O  O20  1  0.23148600  0.48531800  0.22177300  1.0
  O  O21  1  0.48531800  0.23148600  0.72177300  1.0
  O  O22  1  0.99496900  0.13491200  0.79491300  1.0
  O  O23  1  0.80189000  0.39916100  0.27205100  1.0
  O  O24  1  0.85260400  0.65075700  0.29448700  1.0
  O  O25  1  0.35502200  0.49785600  0.46079300  1.0
  O  O26  1  0.76851400  0.51468200  0.77822700  1.0
  O  O27  1  0.39916100  0.80189000  0.77205100  1.0
  O  O28  1  0.65075700  0.85260400  0.79448700  1.0
  O  O29  1  0.60083900  0.19811000  0.22794900  1.0
  O  O30  1  0.73624300  0.04209900  0.49229900  1.0
  O  O31  1  0.51468200  0.76851400  0.27822700  1.0
  O  O32  1  0.95790100  0.26375700  0.00770100  1.0
  O  O33  1  0.14739600  0.34924300  0.70551300  1.0