# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.18003694
_cell_length_b   15.84601098
_cell_length_c   48.75070650
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   95.75648342
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg
_chemical_formula_sum   Mg48
_cell_volume   2444.20382363
_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  0.536022  0.070419  0.330042  1
  Mg  Mg2  1  0.213759  0.425841  0.293655  1
  Mg  Mg3  1  0.374491  0.747346  0.311666  1
  Mg  Mg4  1  0.959986  0.918347  0.303262  1
  Mg  Mg5  1  0.122466  0.243297  0.320956  1
  Mg  Mg6  1  0.798896  0.596144  0.284693  1
  Mg  Mg7  1  0.020910  0.040185  0.385162  1
  Mg  Mg8  1  0.697768  0.393884  0.348389  1
  Mg  Mg9  1  0.859314  0.716985  0.366683  1
  Mg  Mg10  1  0.445131  0.888629  0.357714  1
  Mg  Mg11  1  0.606755  0.211873  0.375873  1
  Mg  Mg12  1  0.283537  0.565427  0.339180  1
  Mg  Mg13  1  0.505636  0.009628  0.440945  1
  Mg  Mg14  1  0.182368  0.363085  0.403912  1
  Mg  Mg15  1  0.344047  0.686446  0.422423  1
  Mg  Mg16  1  0.929902  0.858162  0.413207  1
  Mg  Mg17  1  0.091474  0.181305  0.431612  1
  Mg  Mg18  1  0.768302  0.534956  0.394667  1
  Mg  Mg19  1  0.990443  0.979237  0.496739  1
  Mg  Mg20  1  0.667167  0.332680  0.459665  1
  Mg  Mg21  1  0.828810  0.655967  0.478193  1
  Mg  Mg22  1  0.414682  0.827718  0.468929  1
  Mg  Mg23  1  0.576299  0.150951  0.487420  1
  Mg  Mg24  1  0.253045  0.504441  0.450371  1
  Mg  Mg25  1  0.475252  0.948850  0.552507  1
  Mg  Mg26  1  0.151998  0.302340  0.515458  1
  Mg  Mg27  1  0.313615  0.625573  0.533949  1
  Mg  Mg28  1  0.899487  0.797324  0.524684  1
  Mg  Mg29  1  0.061130  0.120611  0.543213  1
  Mg  Mg30  1  0.737854  0.474054  0.506139  1
  Mg  Mg31  1  0.959995  0.918335  0.608211  1
  Mg  Mg32  1  0.636823  0.271986  0.571266  1
  Mg  Mg33  1  0.798395  0.595129  0.589671  1
  Mg  Mg34  1  0.384250  0.766845  0.580455  1
  Mg  Mg35  1  0.545929  0.090206  0.598965  1
  Mg  Mg36  1  0.222661  0.443663  0.561932  1
  Mg  Mg37  1  0.444760  0.887864  0.663698  1
  Mg  Mg38  1  0.121542  0.241418  0.627004  1
  Mg  Mg39  1  0.283166  0.564662  0.645164  1
  Mg  Mg40  1  0.868983  0.736306  0.636194  1
  Mg  Mg41  1  0.030529  0.059407  0.654489  1
  Mg  Mg42  1  0.707387  0.413106  0.617716  1
  Mg  Mg43  1  0.929401  0.857147  0.718185  1
  Mg  Mg44  1  0.605831  0.209994  0.681922  1
  Mg  Mg45  1  0.768311  0.534944  0.699616  1
  Mg  Mg46  1  0.353806  0.705945  0.691211  1
  Mg  Mg47  1  0.514538  0.027450  0.709222  1
  Mg  Mg48  1  0.192275  0.382872  0.672836  1
