# generated using pymatgen
data_Ca3Yb9(GaIr)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.59143676
_cell_length_b   7.68125918
_cell_length_c   13.78881711
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.09113575
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca3Yb9(GaIr)8
_chemical_formula_sum   'Ca3 Yb9 Ga8 Ir8'
_cell_volume   592.21894702
_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  0.37181757  0.24398708  0.75000000  1.0
  Ca  Ca1  1  0.62831654  0.75526224  0.25000000  1.0
  Ca  Ca2  1  0.62824085  0.74409501  0.75000000  1.0
  Yb  Yb3  1  0.14701450  0.60489075  0.09425251  1.0
  Yb  Yb4  1  0.14755392  0.89494811  0.90681087  1.0
  Yb  Yb5  1  0.85356755  0.10572396  0.40601886  1.0
  Yb  Yb6  1  0.85207028  0.39501590  0.59321984  1.0
  Yb  Yb7  1  0.85207028  0.39501590  0.90678016  1.0
  Yb  Yb8  1  0.85356755  0.10572396  0.09398114  1.0
  Yb  Yb9  1  0.14755392  0.89494811  0.59318913  1.0
  Yb  Yb10  1  0.14701450  0.60489075  0.40574749  1.0
  Yb  Yb11  1  0.37633515  0.25336717  0.25000000  1.0
  Ga  Ga12  1  0.39282046  0.25020978  0.99999378  1.0
  Ga  Ga13  1  0.60601794  0.74992963  0.49931192  1.0
  Ga  Ga14  1  0.60601794  0.74992963  0.00068808  1.0
  Ga  Ga15  1  0.39282046  0.25020978  0.50000622  1.0
  Ga  Ga16  1  0.85015307  0.40606581  0.25000000  1.0
  Ga  Ga17  1  0.84985561  0.09118253  0.75000000  1.0
  Ga  Ga18  1  0.15036768  0.91122571  0.25000000  1.0
  Ga  Ga19  1  0.14991216  0.59090706  0.75000000  1.0
  Ir  Ir20  1  0.64695889  0.46942262  0.09407997  1.0
  Ir  Ir21  1  0.64964604  0.02940539  0.90731272  1.0
  Ir  Ir22  1  0.35201351  0.97266880  0.40593407  1.0
  Ir  Ir23  1  0.34983709  0.52973874  0.59255386  1.0
  Ir  Ir24  1  0.34983709  0.52973874  0.90744614  1.0
  Ir  Ir25  1  0.35201351  0.97266880  0.09406593  1.0
  Ir  Ir26  1  0.64964604  0.02940539  0.59268728  1.0
  Ir  Ir27  1  0.64695889  0.46942262  0.40592003  1.0