# generated using pymatgen
data_TiV3Fe2(PO4)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.53921869
_cell_length_b   8.53921869
_cell_length_c   8.53921948
_cell_angle_alpha   61.08106982
_cell_angle_beta   61.08106982
_cell_angle_gamma   61.08106546
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiV3Fe2(PO4)6
_chemical_formula_sum   'Ti1 V3 Fe2 P6 O24'
_cell_volume   451.00622523
_cell_formula_units_Z   1
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
  Ti  Ti0  1  0.85637200  0.85637200  0.85637200  1.0
  V  V1  1  0.35862400  0.35862400  0.35862400  1.0
  V  V2  1  0.14322900  0.14322900  0.14322900  1.0
  V  V3  1  0.64186800  0.64186800  0.64186800  1.0
  Fe  Fe4  1  0.00009200  0.00009200  0.00009200  1.0
  Fe  Fe5  1  0.50036900  0.50036900  0.50036900  1.0
  P  P6  1  0.74936500  0.04273000  0.45624900  1.0
  P  P7  1  0.04273000  0.45624900  0.74936500  1.0
  P  P8  1  0.45624900  0.74936500  0.04273000  1.0
  P  P9  1  0.54249300  0.25029600  0.95912400  1.0
  P  P10  1  0.95912400  0.54249300  0.25029600  1.0
  P  P11  1  0.25029600  0.95912400  0.54249300  1.0
  O  O12  1  0.88452800  0.49555300  0.68492000  1.0
  O  O13  1  0.49555300  0.68492000  0.88452800  1.0
  O  O14  1  0.68492000  0.88452800  0.49555300  1.0
  O  O15  1  0.91132100  0.05826100  0.26133400  1.0
  O  O16  1  0.81670500  0.99495200  0.61877600  1.0
  O  O17  1  0.59163300  0.23746100  0.44541300  1.0
  O  O18  1  0.05826100  0.26133400  0.91132100  1.0
  O  O19  1  0.23746100  0.44541300  0.59163300  1.0
  O  O20  1  0.38441800  0.18545400  0.99680000  1.0
  O  O21  1  0.44541300  0.59163300  0.23746100  1.0
  O  O22  1  0.73971900  0.08782200  0.94073700  1.0
  O  O23  1  0.99680000  0.38441800  0.18545400  1.0
  O  O24  1  0.99495200  0.61877600  0.81670500  1.0
  O  O25  1  0.26133400  0.91132100  0.05826100  1.0
  O  O26  1  0.56077500  0.40879600  0.76006500  1.0
  O  O27  1  0.61877600  0.81670500  0.99495200  1.0
  O  O28  1  0.76006500  0.56077500  0.40879600  1.0
  O  O29  1  0.94073700  0.73971900  0.08782200  1.0
  O  O30  1  0.40879600  0.76006500  0.56077500  1.0
  O  O31  1  0.18545400  0.99680000  0.38441800  1.0
  O  O32  1  0.08782200  0.94073700  0.73971900  1.0
  O  O33  1  0.31315900  0.11449200  0.50609500  1.0
  O  O34  1  0.50609500  0.31315900  0.11449200  1.0
  O  O35  1  0.11449200  0.50609500  0.31315900  1.0