# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.18952753
_cell_length_b   5.19924216
_cell_length_c   49.89009932
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg
_chemical_formula_sum   Mg16
_cell_volume   827.333803499
_cell_formula_units_Z   16
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  0.501069  0.751895  0.313915  1
  Mg  Mg2  1  1.001069  0.251895  0.296277  1
  Mg  Mg3  1  1.001069  0.751895  0.369476  1
  Mg  Mg4  1  0.501069  0.251895  0.351090  1
  Mg  Mg5  1  0.501069  0.751895  0.425183  1
  Mg  Mg6  1  1.001069  0.251895  0.406584  1
  Mg  Mg7  1  1.001069  0.751895  0.480862  1
  Mg  Mg8  1  0.501069  0.251895  0.462201  1
  Mg  Mg9  1  0.501069  0.751895  0.536516  1
  Mg  Mg10  1  1.001069  0.251895  0.517855  1
  Mg  Mg11  1  1.001069  0.751895  0.592133  1
  Mg  Mg12  1  0.501069  0.251895  0.573534  1
  Mg  Mg13  1  0.501069  0.751895  0.647627  1
  Mg  Mg14  1  1.001069  0.251895  0.629241  1
  Mg  Mg15  1  1.001069  0.751895  0.702440  1
  Mg  Mg16  1  0.501069  0.251895  0.684802  1
