# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.18141504
_cell_length_b   16.50428490
_cell_length_c   46.93013632
_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   Mg48
_cell_volume   2464.15973756
_cell_formula_units_Z   48
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  0.502292  0.606550  0.305937  1
  Mg  Mg2  1  1.002292  0.958320  0.287500  1
  Mg  Mg3  1  1.002292  0.255425  0.324480  1
  Mg  Mg4  1  0.502292  0.423734  0.323786  1
  Mg  Mg5  1  1.002292  0.775646  0.305412  1
  Mg  Mg6  1  0.502292  0.125810  0.287739  1
  Mg  Mg7  1  1.002292  0.552092  0.361633  1
  Mg  Mg8  1  0.502292  0.904040  0.343132  1
  Mg  Mg9  1  0.502292  0.199631  0.379513  1
  Mg  Mg10  1  1.002292  0.366912  0.379181  1
  Mg  Mg11  1  0.502292  0.718497  0.360585  1
  Mg  Mg12  1  1.002292  0.070192  0.342350  1
  Mg  Mg13  1  0.502292  0.495638  0.416747  1
  Mg  Mg14  1  1.002292  0.847454  0.398191  1
  Mg  Mg15  1  1.002292  0.143834  0.435194  1
  Mg  Mg16  1  0.502292  0.310614  0.434855  1
  Mg  Mg17  1  1.002292  0.662831  0.416478  1
  Mg  Mg18  1  0.502292  0.014813  0.398000  1
  Mg  Mg19  1  1.002292  0.439494  0.472344  1
  Mg  Mg20  1  0.502292  0.791629  0.453880  1
  Mg  Mg21  1  0.502292  0.087508  0.490847  1
  Mg  Mg22  1  1.002292  0.254432  0.490647  1
  Mg  Mg23  1  0.502292  0.606403  0.472157  1
  Mg  Mg24  1  1.002292  0.958407  0.453620  1
  Mg  Mg25  1  0.502292  0.383380  0.528036  1
  Mg  Mg26  1  1.002292  0.735351  0.509546  1
  Mg  Mg27  1  1.002292  0.031376  0.546574  1
  Mg  Mg28  1  0.502292  0.198153  0.546313  1
  Mg  Mg29  1  1.002292  0.550288  0.527849  1
  Mg  Mg30  1  0.502292  0.902275  0.509347  1
  Mg  Mg31  1  1.002292  0.326952  0.583715  1
  Mg  Mg32  1  0.502292  0.679168  0.565338  1
  Mg  Mg33  1  0.502292  0.974969  0.602193  1
  Mg  Mg34  1  1.002292  0.142329  0.602002  1
  Mg  Mg35  1  0.502292  0.494145  0.583446  1
  Mg  Mg36  1  1.002292  0.845949  0.565000  1
  Mg  Mg37  1  0.502292  0.271286  0.639608  1
  Mg  Mg38  1  1.002292  0.622871  0.621013  1
  Mg  Mg39  1  1.002292  0.919591  0.657843  1
  Mg  Mg40  1  0.502292  0.085743  0.657061  1
  Mg  Mg41  1  1.002292  0.437690  0.638560  1
  Mg  Mg42  1  0.502292  0.790152  0.620681  1
  Mg  Mg43  1  1.002292  0.214137  0.694781  1
  Mg  Mg44  1  0.502292  0.566049  0.676407  1
  Mg  Mg45  1  0.502292  0.863973  0.712455  1
  Mg  Mg46  1  1.002292  0.031463  0.712693  1
  Mg  Mg47  1  0.502292  0.383233  0.694257  1
  Mg  Mg48  1  1.002292  0.734358  0.675714  1
