# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.18646225
_cell_length_b   3.18646225
_cell_length_c   51.87156638
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg
_chemical_formula_sum   Mg8
_cell_volume   456.118356973
_cell_formula_units_Z   8
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
  Mg  Mg1  1  0.001066  0.000711  0.325924  1
  Mg  Mg2  1  0.667733  0.334044  0.475725  1
  Mg  Mg3  1  0.001066  0.000711  0.425611  1
  Mg  Mg4  1  0.334400  0.667377  0.375562  1
  Mg  Mg5  1  0.001066  0.000711  0.525848  1
  Mg  Mg6  1  0.667733  0.334044  0.675487  1
  Mg  Mg7  1  0.001066  0.000711  0.625927  1
  Mg  Mg8  1  0.334400  0.667377  0.575974  1
