# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.02851108
_cell_length_b   5.02851108
_cell_length_c   47.22914816
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg
_chemical_formula_sum   Mg20
_cell_volume   1034.23580008
_cell_formula_units_Z   20
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  0.750692  0.751385  0.295543  1
  Mg  Mg2  1  0.084026  0.084718  0.317463  1
  Mg  Mg3  1  0.417359  0.418051  0.336478  1
  Mg  Mg4  1  0.750692  0.751385  0.360520  1
  Mg  Mg5  1  0.084026  0.084718  0.381340  1
  Mg  Mg6  1  0.417359  0.418051  0.402326  1
  Mg  Mg7  1  0.750692  0.751385  0.425546  1
  Mg  Mg8  1  0.084026  0.084718  0.446445  1
  Mg  Mg9  1  0.417359  0.418051  0.468314  1
  Mg  Mg10  1  0.750692  0.751385  0.490799  1
  Mg  Mg11  1  0.084026  0.084718  0.511697  1
  Mg  Mg12  1  0.417359  0.418051  0.534182  1
  Mg  Mg13  1  0.750692  0.751385  0.556051  1
  Mg  Mg14  1  0.084026  0.084718  0.576950  1
  Mg  Mg15  1  0.417359  0.418051  0.600170  1
  Mg  Mg16  1  0.750692  0.751385  0.621156  1
  Mg  Mg17  1  0.084026  0.084718  0.641976  1
  Mg  Mg18  1  0.417359  0.418051  0.666018  1
  Mg  Mg19  1  0.750692  0.751385  0.685033  1
  Mg  Mg20  1  0.084026  0.084718  0.706953  1
