# generated using pymatgen
data_Sm3Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.48690091
_cell_length_b   7.28287484
_cell_length_c   9.69538024
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm3Ir
_chemical_formula_sum   'Sm12 Ir4'
_cell_volume   458.04163539
_cell_formula_units_Z   4
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  0.14029114  0.03813306  0.25000000  1.0
  Sm  Sm1  1  0.64029114  0.46186694  0.75000000  1.0
  Sm  Sm2  1  0.35970886  0.53813306  0.25000000  1.0
  Sm  Sm3  1  0.85970886  0.96186694  0.75000000  1.0
  Sm  Sm4  1  0.67539080  0.17123750  0.06505461  1.0
  Sm  Sm5  1  0.17539080  0.32876250  0.93494539  1.0
  Sm  Sm6  1  0.82460920  0.67123750  0.43494539  1.0
  Sm  Sm7  1  0.32460920  0.82876250  0.56505461  1.0
  Sm  Sm8  1  0.32460920  0.82876250  0.93494539  1.0
  Sm  Sm9  1  0.82460920  0.67123750  0.06505461  1.0
  Sm  Sm10  1  0.17539080  0.32876250  0.56505461  1.0
  Sm  Sm11  1  0.67539080  0.17123750  0.43494539  1.0
  Ir  Ir12  1  0.94385502  0.38067013  0.25000000  1.0
  Ir  Ir13  1  0.44385502  0.11932987  0.75000000  1.0
  Ir  Ir14  1  0.55614498  0.88067013  0.25000000  1.0
  Ir  Ir15  1  0.05614498  0.61932987  0.75000000  1.0