# generated using pymatgen
data_SmCu4Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.23078085
_cell_length_b   5.23078035
_cell_length_c   4.01606963
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   124.36462342
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SmCu4Ir
_chemical_formula_sum   'Sm1 Cu4 Ir1'
_cell_volume   90.70503998
_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
  Sm  Sm0  1  0.00000000  0.00000000  0.00000000  1.0
  Cu  Cu1  1  0.32653053  0.67346947  0.00000000  1.0
  Cu  Cu2  1  0.67346947  0.32653053  0.00000000  1.0
  Cu  Cu3  1  0.50000000  0.00000000  0.50000000  1.0
  Cu  Cu4  1  0.00000000  0.50000000  0.50000000  1.0
  Ir  Ir5  1  0.50000000  0.50000000  0.50000000  1.0