# generated using pymatgen
data_Ca4Ga2NiIr3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.57819454
_cell_length_b   5.69940199
_cell_length_c   7.55136957
_cell_angle_alpha   79.32858912
_cell_angle_beta   79.87792245
_cell_angle_gamma   60.55780608
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca4Ga2NiIr3
_chemical_formula_sum   'Ca4 Ga2 Ni1 Ir3'
_cell_volume   204.44551691
_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  0.78505284  0.51036496  0.35492606  1.0
  Ca  Ca1  1  0.49113757  0.21252407  0.14183329  1.0
  Ca  Ca2  1  0.21886023  0.48935165  0.64524009  1.0
  Ca  Ca3  1  0.50279748  0.78615123  0.85797134  1.0
  Ga  Ga4  1  0.09148168  0.90854034  0.25158385  1.0
  Ga  Ga5  1  0.90751728  0.09048757  0.74757510  1.0
  Ni  Ni6  1  0.71944732  0.00657490  0.50971135  1.0
  Ir  Ir7  1  0.00332320  0.71659090  0.01007141  1.0
  Ir  Ir8  1  0.29270713  0.99383763  0.49059270  1.0
  Ir  Ir9  1  0.98767626  0.28557775  0.99049181  1.0