# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.51557943
_cell_length_b   5.06350012
_cell_length_c   45.40788819
_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   808.312033555
_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  1.006609  0.247432  0.305381  1
  Mg  Mg2  1  0.506609  0.747432  0.305381  1
  Mg  Mg3  1  1.006609  0.747432  0.359730  1
  Mg  Mg4  1  0.506609  0.247432  0.359730  1
  Mg  Mg5  1  1.006609  0.247432  0.415538  1
  Mg  Mg6  1  0.506609  0.747432  0.415538  1
  Mg  Mg7  1  1.006609  0.747432  0.471329  1
  Mg  Mg8  1  0.506609  0.247432  0.471329  1
  Mg  Mg9  1  1.006609  0.247432  0.527120  1
  Mg  Mg10  1  0.506609  0.747432  0.527120  1
  Mg  Mg11  1  1.006609  0.747432  0.582911  1
  Mg  Mg12  1  0.506609  0.247432  0.582911  1
  Mg  Mg13  1  1.006609  0.247432  0.638719  1
  Mg  Mg14  1  0.506609  0.747432  0.638719  1
  Mg  Mg15  1  1.006609  0.747432  0.693067  1
  Mg  Mg16  1  0.506609  0.247432  0.693067  1
