# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.19337389
_cell_length_b   11.17223830
_cell_length_c   52.30370980
_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   Mg36
_cell_volume   1866.04646941
_cell_formula_units_Z   36
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  1.057724  0.242696  0.281284  1
  Mg  Mg2  1  0.057724  0.956456  0.269800  1
  Mg  Mg3  1  1.057724  0.685663  0.245388  1
  Mg  Mg4  1  0.557724  0.057910  0.316026  1
  Mg  Mg5  1  0.557724  0.750010  0.292967  1
  Mg  Mg6  1  0.557724  0.446300  0.250291  1
  Mg  Mg7  1  1.057724  0.145508  0.364433  1
  Mg  Mg8  1  1.057724  0.846082  0.337535  1
  Mg  Mg9  1  0.057724  0.517469  0.297429  1
  Mg  Mg10  1  0.557724  0.929271  0.383607  1
  Mg  Mg11  1  0.557724  0.607844  0.345968  1
  Mg  Mg12  1  0.557724  0.330878  0.330083  1
  Mg  Mg13  1  1.057724  0.012428  0.429394  1
  Mg  Mg14  1  1.057724  0.697634  0.394226  1
  Mg  Mg15  1  0.057724  0.419974  0.379084  1
  Mg  Mg16  1  0.557724  0.785605  0.442903  1
  Mg  Mg17  1  0.557724  0.509733  0.427816  1
  Mg  Mg18  1  0.557724  0.233770  0.413027  1
  Mg  Mg19  1  0.057724  0.874459  0.491489  1
  Mg  Mg20  1  1.057724  0.598496  0.476700  1
  Mg  Mg21  1  1.057724  0.322624  0.461613  1
  Mg  Mg22  1  0.557724  0.688255  0.525432  1
  Mg  Mg23  1  0.557724  0.410595  0.510290  1
  Mg  Mg24  1  0.557724  0.095802  0.475122  1
  Mg  Mg25  1  1.057724  0.777351  0.574433  1
  Mg  Mg26  1  0.057724  0.500385  0.558548  1
  Mg  Mg27  1  1.057724  0.178958  0.520909  1
  Mg  Mg28  1  0.557724  0.590760  0.607087  1
  Mg  Mg29  1  0.557724  0.262147  0.566981  1
  Mg  Mg30  1  0.557724  0.962721  0.540082  1
  Mg  Mg31  1  1.057724  0.661929  0.654225  1
  Mg  Mg32  1  0.057724  0.358219  0.611549  1
  Mg  Mg33  1  0.057724  0.050319  0.588490  1
  Mg  Mg34  1  0.557724  0.422566  0.659127  1
  Mg  Mg35  1  0.557724  0.151773  0.634716  1
  Mg  Mg36  1  0.557724  0.865533  0.623232  1
