# generated using pymatgen
data_Ca9CeIr4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.54402832
_cell_length_b   7.54221637
_cell_length_c   8.59755524
_cell_angle_alpha   97.44669545
_cell_angle_beta   112.36929306
_cell_angle_gamma   89.99999991
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca9CeIr4
_chemical_formula_sum   'Ca9 Ce1 Ir4'
_cell_volume   388.54012484
_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  0.97102906  0.91581562  0.17388775  1.0
  Ca  Ca1  1  0.79714132  0.58418438  0.82611225  1.0
  Ca  Ca2  1  0.02250133  0.07771562  0.82361032  1.0
  Ca  Ca3  1  0.19889301  0.42228438  0.17638968  1.0
  Ca  Ca4  1  0.63645035  0.82187991  0.43176284  1.0
  Ca  Ca5  1  0.20468551  0.67812009  0.56823716  1.0
  Ca  Ca6  1  0.36229786  0.17835539  0.55793035  1.0
  Ca  Ca7  1  0.80436852  0.32164461  0.44206965  1.0
  Ca  Ca8  1  0.42429375  0.75000000  0.00000000  1.0
  Ce  Ce9  1  0.55855653  0.25000000  1.00000000  1.0
  Ir  Ir10  1  0.80578447  0.56018187  0.20617364  1.0
  Ir  Ir11  1  0.59961083  0.93981813  0.79382636  1.0
  Ir  Ir12  1  0.20334616  0.40978456  0.79230286  1.0
  Ir  Ir13  1  0.41104130  0.09021544  0.20769714  1.0