# generated using pymatgen
data_Sm(PIr)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.13955319
_cell_length_b   4.13955319
_cell_length_c   9.56972226
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm(PIr)2
_chemical_formula_sum   'Sm2 P4 Ir4'
_cell_volume   163.98580954
_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
  Sm  Sm0  1  0.00000000  0.50000000  0.24283513  1.0
  Sm  Sm1  1  0.50000000  -0.00000000  0.75716487  1.0
  P  P2  1  0.00000000  -0.00000000  -0.00000000  1.0
  P  P3  1  0.50000000  0.50000000  -0.00000000  1.0
  P  P4  1  -0.00000000  0.50000000  0.64003044  1.0
  P  P5  1  0.50000000  0.00000000  0.35996956  1.0
  Ir  Ir6  1  0.00000000  -0.00000000  0.50000000  1.0
  Ir  Ir7  1  0.50000000  0.50000000  0.50000000  1.0
  Ir  Ir8  1  0.00000000  0.50000000  0.88639665  1.0
  Ir  Ir9  1  0.50000000  0.00000000  0.11360335  1.0