# generated using pymatgen
data_Sm2CrFe16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.43933384
_cell_length_b   6.43933384
_cell_length_c   6.43933419
_cell_angle_alpha   82.60181875
_cell_angle_beta   82.60181875
_cell_angle_gamma   82.60182224
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm2CrFe16
_chemical_formula_sum   'Sm2 Cr1 Fe16'
_cell_volume   260.86599820
_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  0.65831400  0.65831400  0.65831400  1.0
  Sm  Sm1  1  0.34587800  0.34587800  0.34587800  1.0
  Cr  Cr2  1  0.09160300  0.09160300  0.09160300  1.0
  Fe  Fe3  1  0.29444400  0.70411000  0.99964800  1.0
  Fe  Fe4  1  0.70411000  0.99964800  0.29444400  1.0
  Fe  Fe5  1  0.99964800  0.29444400  0.70411000  1.0
  Fe  Fe6  1  0.29444400  0.99964800  0.70411000  1.0
  Fe  Fe7  1  0.99964800  0.70411000  0.29444400  1.0
  Fe  Fe8  1  0.70411000  0.29444400  0.99964800  1.0
  Fe  Fe9  1  0.00112200  0.00112200  0.49840500  1.0
  Fe  Fe10  1  0.00112200  0.49840500  0.00112200  1.0
  Fe  Fe11  1  0.49840500  0.00112200  0.00112200  1.0
  Fe  Fe12  1  0.84445100  0.34074900  0.34074900  1.0
  Fe  Fe13  1  0.34074900  0.34074900  0.84445100  1.0
  Fe  Fe14  1  0.34074900  0.84445100  0.34074900  1.0
  Fe  Fe15  1  0.15597600  0.65897200  0.65897200  1.0
  Fe  Fe16  1  0.65897200  0.65897200  0.15597600  1.0
  Fe  Fe17  1  0.65897200  0.15597600  0.65897200  1.0
  Fe  Fe18  1  0.90728200  0.90728200  0.90728200  1.0