# generated using pymatgen
data_Fe4Mo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.60739660
_cell_length_b   2.60739660
_cell_length_c   18.42786926
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe4Mo
_chemical_formula_sum   'Fe8 Mo2'
_cell_volume   125.28218299
_cell_formula_units_Z   2
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
  Fe  Fe0  1  0.50000000  0.50000000  0.88843400  1
  Fe  Fe1  1  0.00000000  0.00000000  0.79414600  1
  Fe  Fe2  1  0.50000000  0.50000000  0.70585400  1
  Fe  Fe3  1  0.00000000  0.00000000  0.61156600  1
  Fe  Fe4  1  0.00000000  0.00000000  0.38843400  1
  Fe  Fe5  1  0.50000000  0.50000000  0.29414600  1
  Fe  Fe6  1  0.00000000  0.00000000  0.20585400  1
  Fe  Fe7  1  0.50000000  0.50000000  0.11156600  1
  Mo  Mo8  1  0.00000000  0.00000000  0.00000000  1
  Mo  Mo9  1  0.50000000  0.50000000  0.50000000  1
