# generated using pymatgen
data_BaMg6Fe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.75167201
_cell_length_b   7.75167201
_cell_length_c   4.94101300
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   133.69526870
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaMg6Fe
_chemical_formula_sum   'Ba1 Mg6 Fe1'
_cell_volume   214.66419077
_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  0.29357800  0.70642200  0.50000000  1.0
  Mg  Mg1  1  0.32016100  0.20424900  0.50000000  1.0
  Mg  Mg2  1  0.79575100  0.67983900  0.50000000  1.0
  Mg  Mg3  1  0.16379900  0.31272000  0.00000000  1.0
  Mg  Mg4  1  0.68728000  0.83620100  0.00000000  1.0
  Mg  Mg5  1  0.71701900  0.28298100  0.00000000  1.0
  Mg  Mg6  1  0.11876900  0.88123100  0.00000000  1.0
  Fe  Fe7  1  0.90364100  0.09635900  0.50000000  1.0