# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.17153423
_cell_length_b   16.46650383
_cell_length_c   46.57465235
_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   2432.31839375
_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  0.501999  0.611640  0.308792  1
  Mg  Mg2  1  1.001999  0.963059  0.290283  1
  Mg  Mg3  1  1.001999  0.258146  0.326090  1
  Mg  Mg4  1  0.501999  0.426582  0.326685  1
  Mg  Mg5  1  1.001999  0.778292  0.308173  1
  Mg  Mg6  1  0.501999  0.127010  0.290583  1
  Mg  Mg7  1  1.001999  0.555058  0.363004  1
  Mg  Mg8  1  0.501999  0.906787  0.344468  1
  Mg  Mg9  1  0.501999  0.203021  0.380890  1
  Mg  Mg10  1  1.001999  0.369614  0.380961  1
  Mg  Mg11  1  0.501999  0.721521  0.362591  1
  Mg  Mg12  1  1.001999  0.072966  0.344412  1
  Mg  Mg13  1  0.501999  0.498573  0.418401  1
  Mg  Mg14  1  1.001999  0.850584  0.399908  1
  Mg  Mg15  1  1.001999  0.147033  0.436887  1
  Mg  Mg16  1  0.501999  0.313605  0.436782  1
  Mg  Mg17  1  1.001999  0.665540  0.418372  1
  Mg  Mg18  1  0.501999  0.017479  0.399912  1
  Mg  Mg19  1  1.001999  0.442887  0.474297  1
  Mg  Mg20  1  0.501999  0.794781  0.455803  1
  Mg  Mg21  1  0.501999  0.091155  0.492828  1
  Mg  Mg22  1  1.001999  0.257920  0.492761  1
  Mg  Mg23  1  0.501999  0.609608  0.474233  1
  Mg  Mg24  1  1.001999  0.961510  0.455718  1
  Mg  Mg25  1  0.501999  0.387281  0.530235  1
  Mg  Mg26  1  1.001999  0.738969  0.511707  1
  Mg  Mg27  1  1.001999  0.035379  0.548750  1
  Mg  Mg28  1  0.501999  0.202109  0.548666  1
  Mg  Mg29  1  1.001999  0.554002  0.530171  1
  Mg  Mg30  1  0.501999  0.905734  0.511640  1
  Mg  Mg31  1  1.001999  0.331350  0.586096  1
  Mg  Mg32  1  0.501999  0.683284  0.567686  1
  Mg  Mg33  1  0.501999  0.979410  0.604556  1
  Mg  Mg34  1  1.001999  0.146306  0.604560  1
  Mg  Mg35  1  0.501999  0.498317  0.586068  1
  Mg  Mg36  1  1.001999  0.849857  0.567581  1
  Mg  Mg37  1  0.501999  0.275369  0.641878  1
  Mg  Mg38  1  1.001999  0.627275  0.623507  1
  Mg  Mg39  1  1.001999  0.923924  0.660056  1
  Mg  Mg40  1  0.501999  0.090102  0.660000  1
  Mg  Mg41  1  1.001999  0.441832  0.641464  1
  Mg  Mg42  1  0.501999  0.793869  0.623579  1
  Mg  Mg43  1  1.001999  0.218597  0.696295  1
  Mg  Mg44  1  0.501999  0.570307  0.677784  1
  Mg  Mg45  1  0.501999  0.869879  0.713885  1
  Mg  Mg46  1  1.001999  0.033830  0.714185  1
  Mg  Mg47  1  0.501999  0.385249  0.695677  1
  Mg  Mg48  1  1.001999  0.738743  0.678378  1
