# generated using pymatgen
data_TiCu3(PO4)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.01836900
_cell_length_b   5.08742500
_cell_length_c   9.87345333
_cell_angle_alpha   89.18236251
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiCu3(PO4)4
_chemical_formula_sum   'Ti1 Cu3 P4 O16'
_cell_volume   302.27462185
_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  0.00000000  0.04005200  0.71851500  1.0
  Cu  Cu1  1  0.50000000  0.87651500  0.30873800  1.0
  Cu  Cu2  1  0.50000000  0.61908000  0.79807600  1.0
  Cu  Cu3  1  0.00000000  0.37436800  0.19292100  1.0
  P  P4  1  0.00000000  0.92254900  0.39071100  1.0
  P  P5  1  0.00000000  0.59690100  0.89830100  1.0
  P  P6  1  0.50000000  0.43366300  0.10760400  1.0
  P  P7  1  0.50000000  0.06080300  0.60201500  1.0
  O  O8  1  0.00000000  0.87748200  0.54882100  1.0
  O  O9  1  0.20008400  0.77808000  0.32767700  1.0
  O  O10  1  0.79991600  0.77808000  0.32767700  1.0
  O  O11  1  0.50000000  0.75979900  0.62251300  1.0
  O  O12  1  0.50000000  0.73213300  0.13545600  1.0
  O  O13  1  0.19243500  0.76268300  0.82934700  1.0
  O  O14  1  0.80756500  0.76268300  0.82934700  1.0
  O  O15  1  0.00000000  0.62445000  0.05178600  1.0
  O  O16  1  0.50000000  0.40216200  0.95231700  1.0
  O  O17  1  0.69897000  0.28341100  0.17277100  1.0
  O  O18  1  0.30103000  0.28341100  0.17277100  1.0
  O  O19  1  0.00000000  0.30873300  0.85708400  1.0
  O  O20  1  0.00000000  0.22251300  0.36778800  1.0
  O  O21  1  0.70794500  0.19057500  0.66990100  1.0
  O  O22  1  0.29205500  0.19057500  0.66990100  1.0
  O  O23  1  0.50000000  0.11929700  0.44796000  1.0