# generated using pymatgen
data_Sm2ZrFe16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.50503748
_cell_length_b   6.50503748
_cell_length_c   6.50503803
_cell_angle_alpha   83.26235077
_cell_angle_beta   83.26235077
_cell_angle_gamma   83.26234907
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm2ZrFe16
_chemical_formula_sum   'Sm2 Zr1 Fe16'
_cell_volume   269.97430760
_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  0.34129100  0.34129100  0.34129100  1.0
  Sm  Sm1  1  0.64825100  0.64825100  0.64825100  1.0
  Zr  Zr2  1  0.90516800  0.90516800  0.90516800  1.0
  Fe  Fe3  1  0.16427000  0.65451000  0.65451000  1.0
  Fe  Fe4  1  0.65451000  0.65451000  0.16427000  1.0
  Fe  Fe5  1  0.65451000  0.16427000  0.65451000  1.0
  Fe  Fe6  1  0.84330000  0.34001600  0.34001600  1.0
  Fe  Fe7  1  0.34001600  0.34001600  0.84330000  1.0
  Fe  Fe8  1  0.34001600  0.84330000  0.34001600  1.0
  Fe  Fe9  1  0.69913900  0.30286600  0.00062900  1.0
  Fe  Fe10  1  0.30286600  0.00062900  0.69913900  1.0
  Fe  Fe11  1  0.00062900  0.69913900  0.30286600  1.0
  Fe  Fe12  1  0.69913900  0.00062900  0.30286600  1.0
  Fe  Fe13  1  0.00062900  0.30286600  0.69913900  1.0
  Fe  Fe14  1  0.30286600  0.69913900  0.00062900  1.0
  Fe  Fe15  1  0.00384600  0.00384600  0.48996300  1.0
  Fe  Fe16  1  0.00384600  0.48996300  0.00384600  1.0
  Fe  Fe17  1  0.48996300  0.00384600  0.00384600  1.0
  Fe  Fe18  1  0.10574600  0.10574600  0.10574600  1.0