# generated using pymatgen
data_NaTiCu4P3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.69490093
_cell_length_b   10.90838961
_cell_length_c   12.47414614
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaTiCu4P3
_chemical_formula_sum   'Na4 Ti4 Cu16 P12'
_cell_volume   502.77568546
_cell_formula_units_Z   4
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
  Na  Na0  1  0.25000000  0.92022149  0.20452203  1.0
  Na  Na1  1  0.75000000  0.07977851  0.79547797  1.0
  Na  Na2  1  0.75000000  0.42022149  0.29547797  1.0
  Na  Na3  1  0.25000000  0.57977851  0.70452203  1.0
  Ti  Ti4  1  0.25000000  0.79299680  0.48679405  1.0
  Ti  Ti5  1  0.75000000  0.20700320  0.51320595  1.0
  Ti  Ti6  1  0.75000000  0.29299680  0.01320595  1.0
  Ti  Ti7  1  0.25000000  0.70700320  0.98679405  1.0
  Cu  Cu8  1  0.25000000  0.08878273  0.98489171  1.0
  Cu  Cu9  1  0.75000000  0.91121727  0.01510829  1.0
  Cu  Cu10  1  0.75000000  0.58878273  0.51510829  1.0
  Cu  Cu11  1  0.25000000  0.41121727  0.48489171  1.0
  Cu  Cu12  1  0.25000000  0.28126020  0.68275662  1.0
  Cu  Cu13  1  0.75000000  0.71873980  0.31724338  1.0
  Cu  Cu14  1  0.75000000  0.78126020  0.81724338  1.0
  Cu  Cu15  1  0.25000000  0.21873980  0.18275662  1.0
  Cu  Cu16  1  0.25000000  0.61451147  0.20106157  1.0
  Cu  Cu17  1  0.75000000  0.38548853  0.79893843  1.0
  Cu  Cu18  1  0.75000000  0.11451147  0.29893843  1.0
  Cu  Cu19  1  0.25000000  0.88548853  0.70106157  1.0
  Cu  Cu20  1  0.25000000  0.03261423  0.43234868  1.0
  Cu  Cu21  1  0.75000000  0.96738577  0.56765132  1.0
  Cu  Cu22  1  0.75000000  0.53261423  0.06765132  1.0
  Cu  Cu23  1  0.25000000  0.46738577  0.93234868  1.0
  P  P24  1  0.25000000  0.08565544  0.61813240  1.0
  P  P25  1  0.75000000  0.91434456  0.38186760  1.0
  P  P26  1  0.75000000  0.58565544  0.88186760  1.0
  P  P27  1  0.25000000  0.41434456  0.11813240  1.0
  P  P28  1  0.25000000  0.23655356  0.37128205  1.0
  P  P29  1  0.75000000  0.76344644  0.62871795  1.0
  P  P30  1  0.75000000  0.73655356  0.12871795  1.0
  P  P31  1  0.25000000  0.26344644  0.87128205  1.0
  P  P32  1  0.25000000  0.89786304  0.89116618  1.0
  P  P33  1  0.75000000  0.10213696  0.10883382  1.0
  P  P34  1  0.75000000  0.39786304  0.60883382  1.0
  P  P35  1  0.25000000  0.60213696  0.39116618  1.0