# generated using pymatgen
data_TiV2Fe3(PO4)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.51763880
_cell_length_b   8.51763880
_cell_length_c   8.51763890
_cell_angle_alpha   61.11155582
_cell_angle_beta   61.11155582
_cell_angle_gamma   61.11155545
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiV2Fe3(PO4)6
_chemical_formula_sum   'Ti1 V2 Fe3 P6 O24'
_cell_volume   447.89317581
_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  0.85427700  0.85427700  0.85427700  1.0
  V  V1  1  0.00065600  0.00065600  0.00065600  1.0
  V  V2  1  0.50082400  0.50082400  0.50082400  1.0
  Fe  Fe3  1  0.35421500  0.35421500  0.35421500  1.0
  Fe  Fe4  1  0.14635300  0.14635300  0.14635300  1.0
  Fe  Fe5  1  0.64543600  0.64543600  0.64543600  1.0
  P  P6  1  0.74936700  0.04622100  0.45266900  1.0
  P  P7  1  0.04622100  0.45266900  0.74936700  1.0
  P  P8  1  0.45266900  0.74936700  0.04622100  1.0
  P  P9  1  0.54587700  0.25007400  0.95338500  1.0
  P  P10  1  0.95338500  0.54587700  0.25007400  1.0
  P  P11  1  0.25007400  0.95338500  0.54587700  1.0
  O  O12  1  0.89284900  0.49640500  0.67695800  1.0
  O  O13  1  0.49640500  0.67695800  0.89284900  1.0
  O  O14  1  0.67695800  0.89284900  0.49640500  1.0
  O  O15  1  0.90738600  0.06151100  0.25624700  1.0
  O  O16  1  0.82162600  0.99273800  0.61496800  1.0
  O  O17  1  0.59352600  0.24452000  0.44517600  1.0
  O  O18  1  0.06151100  0.25624700  0.90738600  1.0
  O  O19  1  0.24452000  0.44517600  0.59352600  1.0
  O  O20  1  0.39268300  0.17772700  0.99602600  1.0
  O  O21  1  0.44517600  0.59352600  0.24452000  1.0
  O  O22  1  0.74646600  0.09043500  0.93586000  1.0
  O  O23  1  0.99602600  0.39268300  0.17772700  1.0
  O  O24  1  0.99273800  0.61496800  0.82162600  1.0
  O  O25  1  0.25624700  0.90738600  0.06151100  1.0
  O  O26  1  0.56260400  0.40665500  0.75391200  1.0
  O  O27  1  0.61496800  0.82162600  0.99273800  1.0
  O  O28  1  0.75391200  0.56260400  0.40665500  1.0
  O  O29  1  0.93586000  0.74646600  0.09043500  1.0
  O  O30  1  0.40665500  0.75391200  0.56260400  1.0
  O  O31  1  0.17772700  0.99602600  0.39268300  1.0
  O  O32  1  0.09043500  0.93586000  0.74646600  1.0
  O  O33  1  0.31714800  0.10937800  0.50783100  1.0
  O  O34  1  0.50783100  0.31714800  0.10937800  1.0
  O  O35  1  0.10937800  0.50783100  0.31714800  1.0