# generated using pymatgen
data_TiCu(PO4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.58531843
_cell_length_b   8.58531843
_cell_length_c   8.58531875
_cell_angle_alpha   60.20147293
_cell_angle_beta   60.20147293
_cell_angle_gamma   60.20147531
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiCu(PO4)2
_chemical_formula_sum   'Ti3 Cu3 P6 O24'
_cell_volume   449.50137058
_cell_formula_units_Z   3
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  0.64341500  0.64341500  0.64341500  1.0
  Ti  Ti1  1  0.85734600  0.85734600  0.85734600  1.0
  Ti  Ti2  1  0.35665800  0.35665800  0.35665800  1.0
  Cu  Cu3  1  0.00275000  0.00275000  0.00275000  1.0
  Cu  Cu4  1  0.14479200  0.14479200  0.14479200  1.0
  Cu  Cu5  1  0.50053900  0.50053900  0.50053900  1.0
  P  P6  1  0.53908500  0.95886600  0.24843600  1.0
  P  P7  1  0.24843600  0.53908500  0.95886600  1.0
  P  P8  1  0.95886600  0.24843600  0.53908500  1.0
  P  P9  1  0.04210200  0.75323800  0.45515400  1.0
  P  P10  1  0.75323800  0.45515400  0.04210200  1.0
  P  P11  1  0.45515400  0.04210200  0.75323800  1.0
  O  O12  1  0.30629200  0.49783600  0.12409900  1.0
  O  O13  1  0.12409900  0.30629200  0.49783600  1.0
  O  O14  1  0.49783600  0.12409900  0.30629200  1.0
  O  O15  1  0.73585200  0.94429500  0.08435900  1.0
  O  O16  1  0.38366800  0.98509000  0.19472500  1.0
  O  O17  1  0.56316900  0.76603600  0.41572800  1.0
  O  O18  1  0.08435900  0.73585200  0.94429500  1.0
  O  O19  1  0.41572800  0.56316900  0.76603600  1.0
  O  O20  1  0.99922300  0.80884500  0.62194300  1.0
  O  O21  1  0.76603600  0.41572800  0.56316900  1.0
  O  O22  1  0.05169500  0.91631500  0.26357900  1.0
  O  O23  1  0.80884500  0.62194300  0.99922300  1.0
  O  O24  1  0.19472500  0.38366800  0.98509000  1.0
  O  O25  1  0.94429500  0.08435900  0.73585200  1.0
  O  O26  1  0.23376600  0.58495200  0.44386100  1.0
  O  O27  1  0.98509000  0.19472500  0.38366800  1.0
  O  O28  1  0.58495200  0.44386100  0.23376600  1.0
  O  O29  1  0.91631500  0.26357900  0.05169500  1.0
  O  O30  1  0.44386100  0.23376600  0.58495200  1.0
  O  O31  1  0.62194300  0.99922300  0.80884500  1.0
  O  O32  1  0.26357900  0.05169500  0.91631500  1.0
  O  O33  1  0.50268600  0.87865900  0.69093400  1.0
  O  O34  1  0.87865900  0.69093400  0.50268600  1.0
  O  O35  1  0.69093400  0.50268600  0.87865900  1.0