# generated using pymatgen
data_TiCr3(PO4)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.80901793
_cell_length_b   8.80901793
_cell_length_c   8.80901820
_cell_angle_alpha   58.42045675
_cell_angle_beta   58.42045675
_cell_angle_gamma   58.42045446
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiCr3(PO4)6
_chemical_formula_sum   'Ti1 Cr3 P6 O24'
_cell_volume   465.88332985
_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  0.85952400  0.85952400  0.85952400  1.0
  Cr  Cr1  1  0.14286100  0.14286100  0.14286100  1.0
  Cr  Cr2  1  0.35722100  0.35722100  0.35722100  1.0
  Cr  Cr3  1  0.64288100  0.64288100  0.64288100  1.0
  P  P4  1  0.03397500  0.46481300  0.75074100  1.0
  P  P5  1  0.46481300  0.75074100  0.03397500  1.0
  P  P6  1  0.75074100  0.03397500  0.46481300  1.0
  P  P7  1  0.25417400  0.96692200  0.53037400  1.0
  P  P8  1  0.53037400  0.25417400  0.96692200  1.0
  P  P9  1  0.96692200  0.53037400  0.25417400  1.0
  O  O10  1  0.13740400  0.50475700  0.28332400  1.0
  O  O11  1  0.28332400  0.13740400  0.50475700  1.0
  O  O12  1  0.06275400  0.28088400  0.92282600  1.0
  O  O13  1  0.50475700  0.28332400  0.13740400  1.0
  O  O14  1  0.21730600  0.43382100  0.57845000  1.0
  O  O15  1  0.00581800  0.63759300  0.77832600  1.0
  O  O16  1  0.28088400  0.92282600  0.06275400  1.0
  O  O17  1  0.43382100  0.57845000  0.21730600  1.0
  O  O18  1  0.57845000  0.21730600  0.43382100  1.0
  O  O19  1  0.22459100  0.99224600  0.36024500  1.0
  O  O20  1  0.07945800  0.93961300  0.71183300  1.0
  O  O21  1  0.36024500  0.22459100  0.99224600  1.0
  O  O22  1  0.63759300  0.77832600  0.00581800  1.0
  O  O23  1  0.92282600  0.06275400  0.28088400  1.0
  O  O24  1  0.77832600  0.00581800  0.63759300  1.0
  O  O25  1  0.42743500  0.78495100  0.55765300  1.0
  O  O26  1  0.55765300  0.42743500  0.78495100  1.0
  O  O27  1  0.71183300  0.07945800  0.93961300  1.0
  O  O28  1  0.99224600  0.36024500  0.22459100  1.0
  O  O29  1  0.78495100  0.55765300  0.42743500  1.0
  O  O30  1  0.49038100  0.72200000  0.86284100  1.0
  O  O31  1  0.93961300  0.71183300  0.07945800  1.0
  O  O32  1  0.72200000  0.86284100  0.49038100  1.0
  O  O33  1  0.86284100  0.49038100  0.72200000  1.0