# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.15919664
_cell_length_b   5.18594850
_cell_length_c   48.81786893
_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   799.804191688
_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  0.563758  0.485687  0.304919  1
  Mg  Mg2  1  1.063758  0.485687  0.250216  1
  Mg  Mg3  1  0.563758  0.985687  0.341310  1
  Mg  Mg4  1  1.063758  0.985687  0.285410  1
  Mg  Mg5  1  0.563758  0.485687  0.417357  1
  Mg  Mg6  1  1.063758  0.485687  0.360836  1
  Mg  Mg7  1  0.563758  0.985687  0.454740  1
  Mg  Mg8  1  1.063758  0.985687  0.398045  1
  Mg  Mg9  1  0.563758  0.485687  0.530660  1
  Mg  Mg10  1  1.063758  0.485687  0.473966  1
  Mg  Mg11  1  0.563758  0.985687  0.567870  1
  Mg  Mg12  1  1.063758  0.985687  0.511349  1
  Mg  Mg13  1  0.563758  0.485687  0.643295  1
  Mg  Mg14  1  1.063758  0.485687  0.587395  1
  Mg  Mg15  1  0.563758  0.985687  0.678490  1
  Mg  Mg16  1  1.063758  0.985687  0.623787  1
