# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.18037495
_cell_length_b   13.43101617
_cell_length_c   50.75718657
_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   Mg42
_cell_volume   2168.12709825
_cell_formula_units_Z   42
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  1.059906  0.431286  0.281278  1
  Mg  Mg2  1  1.059906  0.208516  0.260759  1
  Mg  Mg3  1  1.059906  0.839869  0.288061  1
  Mg  Mg4  1  0.559906  0.265452  0.312092  1
  Mg  Mg5  1  0.559906  0.006483  0.257505  1
  Mg  Mg6  1  0.559906  0.635574  0.284977  1
  Mg  Mg7  1  1.059906  0.321311  0.364184  1
  Mg  Mg8  1  1.059906  0.062054  0.308636  1
  Mg  Mg9  1  1.059906  0.691494  0.336347  1
  Mg  Mg10  1  0.559906  0.117526  0.360726  1
  Mg  Mg11  1  0.559906  0.895179  0.339716  1
  Mg  Mg12  1  0.559906  0.487683  0.332787  1
  Mg  Mg13  1  1.059906  0.173199  0.413002  1
  Mg  Mg14  1  1.059906  0.950911  0.392048  1
  Mg  Mg15  1  1.059906  0.543522  0.385021  1
  Mg  Mg16  1  0.559906  0.006527  0.444399  1
  Mg  Mg17  1  0.559906  0.747288  0.388556  1
  Mg  Mg18  1  0.559906  0.376932  0.416473  1
  Mg  Mg19  1  1.059906  0.062072  0.496749  1
  Mg  Mg20  1  1.059906  0.802827  0.440886  1
  Mg  Mg21  1  1.059906  0.432458  0.468789  1
  Mg  Mg22  1  0.559906  0.858363  0.493218  1
  Mg  Mg23  1  0.559906  0.599118  0.437356  1
  Mg  Mg24  1  0.559906  0.228732  0.465315  1
  Mg  Mg25  1  1.059906  0.913902  0.545548  1
  Mg  Mg26  1  1.059906  0.654664  0.489706  1
  Mg  Mg27  1  1.059906  0.284258  0.517632  1
  Mg  Mg28  1  0.559906  0.710279  0.542056  1
  Mg  Mg29  1  0.559906  0.487992  0.521103  1
  Mg  Mg30  1  0.559906  0.117668  0.549084  1
  Mg  Mg31  1  1.059906  0.766011  0.594388  1
  Mg  Mg32  1  1.059906  0.543664  0.573378  1
  Mg  Mg33  1  1.059906  0.173507  0.601317  1
  Mg  Mg34  1  0.559906  0.599137  0.625468  1
  Mg  Mg35  1  0.559906  0.339879  0.569920  1
  Mg  Mg36  1  0.559906  0.969696  0.597757  1
  Mg  Mg37  1  1.059906  0.654707  0.676599  1
  Mg  Mg38  1  1.059906  0.395739  0.622013  1
  Mg  Mg39  1  1.059906  0.025616  0.649127  1
  Mg  Mg40  1  0.559906  0.452674  0.673346  1
  Mg  Mg41  1  0.559906  0.229904  0.652826  1
  Mg  Mg42  1  0.559906  0.821322  0.646044  1
