# generated using pymatgen
data_BaMg6Fe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.41796381
_cell_length_b   7.41796381
_cell_length_c   4.89794000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   129.81243489
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaMg6Fe
_chemical_formula_sum   'Ba1 Mg6 Fe1'
_cell_volume   207.02645843
_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
  Ba  Ba0  1  0.79343000  0.20657000  0.00000000  1.0
  Mg  Mg1  1  0.20543200  0.30717200  0.50000000  1.0
  Mg  Mg2  1  0.69282800  0.79456800  0.50000000  1.0
  Mg  Mg3  1  0.18365000  0.81635000  0.50000000  1.0
  Mg  Mg4  1  0.32907900  0.18233800  0.00000000  1.0
  Mg  Mg5  1  0.81766200  0.67092100  0.00000000  1.0
  Mg  Mg6  1  0.35610600  0.64389400  0.00000000  1.0
  Fe  Fe7  1  0.62181400  0.37818600  0.50000000  1.0