# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.19414448
_cell_length_b   5.51519997
_cell_length_c   46.97918847
_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   827.601616781
_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  0.062703  0.210856  0.292779  1
  Mg  Mg2  1  0.562703  0.710856  0.292779  1
  Mg  Mg3  1  0.062703  0.876669  0.348038  1
  Mg  Mg4  1  0.562703  0.376669  0.348038  1
  Mg  Mg5  1  0.062703  0.210859  0.403566  1
  Mg  Mg6  1  0.562703  0.710859  0.403566  1
  Mg  Mg7  1  0.062703  0.876667  0.459121  1
  Mg  Mg8  1  0.562703  0.376667  0.459121  1
  Mg  Mg9  1  0.062703  0.210883  0.514737  1
  Mg  Mg10  1  0.562703  0.710883  0.514737  1
  Mg  Mg11  1  0.062703  0.545099  0.570353  1
  Mg  Mg12  1  0.562703  0.045099  0.570353  1
  Mg  Mg13  1  0.062703  0.210909  0.625880  1
  Mg  Mg14  1  0.562703  0.710909  0.625880  1
  Mg  Mg15  1  0.062703  0.545096  0.681139  1
  Mg  Mg16  1  0.562703  0.045096  0.681139  1
