# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.17688910
_cell_length_b   15.84307919
_cell_length_c   48.62670580
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   95.75556444
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg
_chemical_formula_sum   Mg48
_cell_volume   2435.12683469
_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  0.536431  0.070538  0.331041  1
  Mg  Mg2  1  0.214164  0.426037  0.295122  1
  Mg  Mg3  1  0.374627  0.746939  0.312649  1
  Mg  Mg4  1  0.960012  0.917702  0.304971  1
  Mg  Mg5  1  0.123297  0.244280  0.322306  1
  Mg  Mg6  1  0.798687  0.595066  0.286331  1
  Mg  Mg7  1  0.021336  0.040355  0.385850  1
  Mg  Mg8  1  0.698348  0.394390  0.349404  1
  Mg  Mg9  1  0.859783  0.717254  0.367365  1
  Mg  Mg10  1  0.445486  0.888656  0.358673  1
  Mg  Mg11  1  0.607171  0.212028  0.376704  1
  Mg  Mg12  1  0.283863  0.565418  0.340181  1
  Mg  Mg13  1  0.506033  0.009754  0.441831  1
  Mg  Mg14  1  0.182734  0.363162  0.404828  1
  Mg  Mg15  1  0.344511  0.686713  0.423308  1
  Mg  Mg16  1  0.930312  0.858312  0.414131  1
  Mg  Mg17  1  0.091833  0.181356  0.432509  1
  Mg  Mg18  1  0.768772  0.535237  0.395641  1
  Mg  Mg19  1  0.990843  0.979378  0.497788  1
  Mg  Mg20  1  0.667512  0.332720  0.460706  1
  Mg  Mg21  1  0.829192  0.656079  0.479229  1
  Mg  Mg22  1  0.415074  0.827838  0.469982  1
  Mg  Mg23  1  0.576682  0.151055  0.488464  1
  Mg  Mg24  1  0.253408  0.504510  0.451413  1
  Mg  Mg25  1  0.475635  0.948964  0.553688  1
  Mg  Mg26  1  0.152361  0.302419  0.516636  1
  Mg  Mg27  1  0.313969  0.625635  0.535118  1
  Mg  Mg28  1  0.899851  0.797395  0.525872  1
  Mg  Mg29  1  0.061531  0.120754  0.544395  1
  Mg  Mg30  1  0.738200  0.474096  0.507313  1
  Mg  Mg31  1  0.960271  0.918236  0.609460  1
  Mg  Mg32  1  0.637210  0.272118  0.572591  1
  Mg  Mg33  1  0.798731  0.595162  0.590970  1
  Mg  Mg34  1  0.384532  0.766761  0.581793  1
  Mg  Mg35  1  0.546309  0.090312  0.600273  1
  Mg  Mg36  1  0.223010  0.443720  0.563270  1
  Mg  Mg37  1  0.445180  0.888056  0.664920  1
  Mg  Mg38  1  0.121872  0.241446  0.628397  1
  Mg  Mg39  1  0.283557  0.564818  0.646427  1
  Mg  Mg40  1  0.869260  0.736220  0.637736  1
  Mg  Mg41  1  0.030695  0.059084  0.655697  1
  Mg  Mg42  1  0.707707  0.413118  0.619251  1
  Mg  Mg43  1  0.930356  0.858408  0.718770  1
  Mg  Mg44  1  0.605746  0.209194  0.682795  1
  Mg  Mg45  1  0.769031  0.535772  0.700130  1
  Mg  Mg46  1  0.354416  0.706535  0.692451  1
  Mg  Mg47  1  0.514879  0.027437  0.709978  1
  Mg  Mg48  1  0.192612  0.382935  0.674059  1
