# generated using pymatgen
data_Ca7Tb2PrIr4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.62474271
_cell_length_b   7.44015771
_cell_length_c   8.71024002
_cell_angle_alpha   96.82057530
_cell_angle_beta   113.27585768
_cell_angle_gamma   90.54698549
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca7Tb2PrIr4
_chemical_formula_sum   'Ca7 Tb2 Pr1 Ir4'
_cell_volume   390.83666009
_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  0.79997340  0.57676674  0.82143919  1.0
  Ca  Ca1  1  0.02179339  0.08233238  0.81934919  1.0
  Ca  Ca2  1  0.19288934  0.41713567  0.17369428  1.0
  Ca  Ca3  1  0.63590638  0.81824545  0.43136032  1.0
  Ca  Ca4  1  0.20328372  0.68115779  0.56578835  1.0
  Ca  Ca5  1  0.36872847  0.17930115  0.56978903  1.0
  Ca  Ca6  1  0.80174602  0.31904300  0.43430614  1.0
  Tb  Tb7  1  0.42928008  0.74628112  0.99656831  1.0
  Tb  Tb8  1  0.56096335  0.25389135  0.00328652  1.0
  Pr  Pr9  1  0.97427575  0.91934819  0.16957180  1.0
  Ir  Ir10  1  0.81037301  0.58233990  0.20972417  1.0
  Ir  Ir11  1  0.61265824  0.92805642  0.81056018  1.0
  Ir  Ir12  1  0.19472673  0.42406071  0.78799867  1.0
  Ir  Ir13  1  0.39340313  0.07203912  0.20656384  1.0