# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.95742114
_cell_length_b   7.95175911
_cell_length_c   46.19306972
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   78.46304097
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg
_chemical_formula_sum   Mg56
_cell_volume   2863.83504401
_cell_formula_units_Z   56
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  0.875781  0.876378  0.305517  1
  Mg  Mg2  1  0.374492  0.375025  0.305528  1
  Mg  Mg3  1  0.250847  0.750701  0.325847  1
  Mg  Mg4  1  0.750119  0.251532  0.325838  1
  Mg  Mg5  1  0.499270  0.499850  0.364582  1
  Mg  Mg6  1  0.125113  0.125678  0.305203  1
  Mg  Mg7  1  1.000091  0.501095  0.325850  1
  Mg  Mg8  1  0.500548  1.000534  0.325841  1
  Mg  Mg9  1  0.749724  0.750265  0.364513  1
  Mg  Mg10  1  0.249185  0.249711  0.364089  1
  Mg  Mg11  1  0.124922  0.625567  0.385073  1
  Mg  Mg12  1  0.625008  0.125482  0.385068  1
  Mg  Mg13  1  0.373527  0.374079  0.424582  1
  Mg  Mg14  1  0.999995  1.000590  0.364080  1
  Mg  Mg15  1  0.875828  0.374663  0.385499  1
  Mg  Mg16  1  0.374097  0.876381  0.385499  1
  Mg  Mg17  1  0.623622  0.624175  0.424676  1
  Mg  Mg18  1  0.123548  0.124101  0.424815  1
  Mg  Mg19  1  0.999232  0.499968  0.445989  1
  Mg  Mg20  1  0.499419  0.999784  0.445988  1
  Mg  Mg21  1  0.246932  0.247473  0.485425  1
  Mg  Mg22  1  0.873665  0.874220  0.424570  1
  Mg  Mg23  1  0.749044  0.249750  0.446018  1
  Mg  Mg24  1  0.249201  0.749597  0.446020  1
  Mg  Mg25  1  0.497158  0.497699  0.485445  1
  Mg  Mg26  1  0.997222  0.997766  0.485496  1
  Mg  Mg27  1  0.873232  0.373690  0.506857  1
  Mg  Mg28  1  0.373153  0.873773  0.506857  1
  Mg  Mg29  1  0.119803  0.120330  0.546425  1
  Mg  Mg30  1  0.747208  0.747751  0.485439  1
  Mg  Mg31  1  0.623102  0.123528  0.506743  1
  Mg  Mg32  1  0.122989  0.623640  0.506742  1
  Mg  Mg33  1  0.369386  0.369912  0.545912  1
  Mg  Mg34  1  0.870029  0.870551  0.546155  1
  Mg  Mg35  1  0.746532  0.246231  0.567515  1
  Mg  Mg36  1  0.245711  0.747048  0.567514  1
  Mg  Mg37  1  0.990506  0.991005  0.607437  1
  Mg  Mg38  1  0.620109  0.620635  0.546222  1
  Mg  Mg39  1  0.496300  0.997288  0.567777  1
  Mg  Mg40  1  0.996767  0.496819  0.567775  1
  Mg  Mg41  1  0.241587  0.242098  0.607205  1
  Mg  Mg42  1  0.742324  0.742815  0.606822  1
  Mg  Mg43  1  0.619632  0.118357  0.628703  1
  Mg  Mg44  1  0.117867  0.620124  0.628703  1
  Mg  Mg45  1  0.861417  0.861923  0.668881  1
  Mg  Mg46  1  0.489620  0.490117  0.606028  1
  Mg  Mg47  1  0.366707  0.869260  0.628021  1
  Mg  Mg48  1  0.868774  0.367200  0.628024  1
  Mg  Mg49  1  0.111901  0.112348  0.666698  1
  Mg  Mg50  1  0.611353  0.611838  0.663720  1
  Mg  Mg51  1  0.489854  0.990050  0.687156  1
  Mg  Mg52  1  0.989643  0.490296  0.687151  1
  Mg  Mg53  1  0.688762  0.689009  0.723618  1
  Mg  Mg54  1  0.363738  0.364183  0.666596  1
  Mg  Mg55  1  0.248086  0.737402  0.688563  1
  Mg  Mg56  1  0.736936  0.248591  0.688570  1
