# generated using pymatgen
data_Sm2FeSi4Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.05486648
_cell_length_b   4.37062029
_cell_length_c   8.05388197
_cell_angle_alpha   77.67846600
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm2FeSi4Ir
_chemical_formula_sum   'Sm2 Fe1 Si4 Ir1'
_cell_volume   139.44536971
_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  0.25000000  0.60043602  0.79867906  1.0
  Sm  Sm1  1  0.75000000  0.41831028  0.20173804  1.0
  Fe  Fe2  1  0.75000000  0.11548190  0.60668761  1.0
  Si  Si3  1  0.25000000  0.97439042  0.08415760  1.0
  Si  Si4  1  0.75000000  0.04398164  0.89994235  1.0
  Si  Si5  1  0.25000000  0.31717377  0.50468017  1.0
  Si  Si6  1  0.75000000  0.65249200  0.51856745  1.0
  Ir  Ir7  1  0.25000000  0.87773397  0.38554771  1.0