# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.07421502
_cell_length_b   5.07421502
_cell_length_c   47.60630436
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg
_chemical_formula_sum   Mg20
_cell_volume   1061.53137039
_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  0.251400  0.750933  0.296880  1
  Mg  Mg2  1  0.918067  0.084267  0.316585  1
  Mg  Mg3  1  0.584734  0.417600  0.336208  1
  Mg  Mg4  1  0.251400  0.750933  0.360411  1
  Mg  Mg5  1  0.918067  0.084267  0.381513  1
  Mg  Mg6  1  0.584734  0.417600  0.402584  1
  Mg  Mg7  1  0.251400  0.750933  0.425340  1
  Mg  Mg8  1  0.918067  0.084267  0.446805  1
  Mg  Mg9  1  0.584734  0.417600  0.468472  1
  Mg  Mg10  1  0.251400  0.750933  0.490566  1
  Mg  Mg11  1  0.918067  0.084267  0.512124  1
  Mg  Mg12  1  0.584734  0.417600  0.534218  1
  Mg  Mg13  1  0.251400  0.750933  0.555885  1
  Mg  Mg14  1  0.918067  0.084267  0.577350  1
  Mg  Mg15  1  0.584734  0.417600  0.600106  1
  Mg  Mg16  1  0.251400  0.750933  0.621177  1
  Mg  Mg17  1  0.918067  0.084267  0.642279  1
  Mg  Mg18  1  0.584734  0.417600  0.666482  1
  Mg  Mg19  1  0.251400  0.750933  0.686105  1
  Mg  Mg20  1  0.918067  0.084267  0.705810  1
