# generated using pymatgen
data_LaCuP2Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.25639680
_cell_length_b   4.25639680
_cell_length_c   9.46248013
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaCuP2Ir
_chemical_formula_sum   'La2 Cu2 P4 Ir2'
_cell_volume   171.43093627
_cell_formula_units_Z   2
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
  La  La0  1  0.00000000  0.50000000  0.25407269  1.0
  La  La1  1  0.50000000  0.00000000  0.74592731  1.0
  Cu  Cu2  1  0.00000000  0.00000000  0.00000000  1.0
  Cu  Cu3  1  0.50000000  0.50000000  0.00000000  1.0
  P  P4  1  0.00000000  0.00000000  0.50000000  1.0
  P  P5  1  0.50000000  0.50000000  0.50000000  1.0
  P  P6  1  0.00000000  0.50000000  0.86452990  1.0
  P  P7  1  0.50000000  0.00000000  0.13547010  1.0
  Ir  Ir8  1  0.00000000  0.50000000  0.60856518  1.0
  Ir  Ir9  1  0.50000000  0.00000000  0.39143482  1.0