# generated using pymatgen
data_CaPr16(TmGa4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.85291141
_cell_length_b   7.85291141
_cell_length_c   14.68035752
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaPr16(TmGa4)3
_chemical_formula_sum   'Ca1 Pr16 Tm3 Ga12'
_cell_volume   905.31148195
_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
  Ca  Ca0  1  0.00000000  0.50000000  0.73444097  1.0
  Pr  Pr1  1  0.81506351  0.83571559  0.60368823  1.0
  Pr  Pr2  1  0.18464009  0.83752177  0.10418477  1.0
  Pr  Pr3  1  0.16169158  0.81519641  0.39502981  1.0
  Pr  Pr4  1  0.83830842  0.18480359  0.39502981  1.0
  Pr  Pr5  1  0.68480359  0.66169158  0.39502981  1.0
  Pr  Pr6  1  0.66428441  0.31506351  0.60368823  1.0
  Pr  Pr7  1  0.33571559  0.68493649  0.60368823  1.0
  Pr  Pr8  1  0.66247823  0.68464009  0.10418477  1.0
  Pr  Pr9  1  0.68253340  0.33541666  0.89715957  1.0
  Pr  Pr10  1  0.83541666  0.81746660  0.89715957  1.0
  Pr  Pr11  1  0.31519641  0.33830842  0.39502981  1.0
  Pr  Pr12  1  0.18493649  0.16428441  0.60368823  1.0
  Pr  Pr13  1  0.81535991  0.16247823  0.10418477  1.0
  Pr  Pr14  1  0.31746660  0.66458334  0.89715957  1.0
  Pr  Pr15  1  0.33752177  0.31535991  0.10418477  1.0
  Pr  Pr16  1  0.16458334  0.18253340  0.89715957  1.0
  Tm  Tm17  1  0.00000000  0.50000000  0.22583811  1.0
  Tm  Tm18  1  0.50000000  0.00000000  0.27531015  1.0
  Tm  Tm19  1  0.50000000  0.00000000  0.77224899  1.0
  Ga  Ga20  1  0.62062443  0.37960203  0.24919400  1.0
  Ga  Ga21  1  0.12344141  0.88733823  0.75045198  1.0
  Ga  Ga22  1  0.38733823  0.37655859  0.75045198  1.0
  Ga  Ga23  1  0.37937557  0.62039797  0.24919400  1.0
  Ga  Ga24  1  0.87960203  0.87937557  0.24919400  1.0
  Ga  Ga25  1  0.61266177  0.62344141  0.75045198  1.0
  Ga  Ga26  1  0.00000000  0.50000000  0.50842325  1.0
  Ga  Ga27  1  0.87655859  0.11266177  0.75045198  1.0
  Ga  Ga28  1  0.50000000  0.00000000  0.48509347  1.0
  Ga  Ga29  1  0.50000000  0.00000000  0.98572803  1.0
  Ga  Ga30  1  0.12039797  0.12062443  0.24919400  1.0
  Ga  Ga31  1  0.00000000  0.50000000  0.01408560  1.0