# generated using pymatgen
data_SmFe3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.18314814
_cell_length_b   5.18314800
_cell_length_c   8.70360880
_cell_angle_alpha   72.67697349
_cell_angle_beta   72.67697333
_cell_angle_gamma   60.00000089
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SmFe3
_chemical_formula_sum   'Sm3 Fe9'
_cell_volume   190.15114323
_cell_formula_units_Z   3
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  0.85794900  0.85794900  0.42615300  1.0
  Sm  Sm1  1  0.14205100  0.14205100  0.57384700  1.0
  Sm  Sm2  1  0.00000000  0.00000000  0.00000000  1.0
  Fe  Fe3  1  0.42142900  0.42142900  0.24083000  1.0
  Fe  Fe4  1  0.91631200  0.42142900  0.24083000  1.0
  Fe  Fe5  1  0.42142900  0.91631200  0.24083000  1.0
  Fe  Fe6  1  0.57857100  0.57857100  0.75917000  1.0
  Fe  Fe7  1  0.08368800  0.57857100  0.75917000  1.0
  Fe  Fe8  1  0.57857100  0.08368800  0.75917000  1.0
  Fe  Fe9  1  0.66728300  0.66728300  0.99815100  1.0
  Fe  Fe10  1  0.33271700  0.33271700  0.00184900  1.0
  Fe  Fe11  1  0.50000000  0.50000000  0.50000000  1.0