# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.17422913
_cell_length_b   6.07740206
_cell_length_c   48.62173132
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   105.17158518
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg
_chemical_formula_sum   Mg18
_cell_volume   905.273605993
_cell_formula_units_Z   18
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  0.475733  0.447645  0.297430  1
  Mg  Mg2  1  0.207872  0.911581  0.305313  1
  Mg  Mg3  1  0.864671  0.225426  0.346527  1
  Mg  Mg4  1  0.596512  0.689007  0.354571  1
  Mg  Mg5  1  0.253874  0.003987  0.396415  1
  Mg  Mg6  1  0.985856  0.467862  0.404665  1
  Mg  Mg7  1  0.643555  0.783507  0.446565  1
  Mg  Mg8  1  0.375411  0.247133  0.454830  1
  Mg  Mg9  1  0.033215  0.562987  0.496738  1
  Mg  Mg10  1  0.765082  0.026634  0.505021  1
  Mg  Mg11  1  0.422886  0.342489  0.546929  1
  Mg  Mg12  1  0.154742  0.806115  0.555195  1
  Mg  Mg13  1  0.812441  0.121759  0.597094  1
  Mg  Mg14  1  0.544423  0.585635  0.605344  1
  Mg  Mg15  1  0.201785  0.900614  0.647188  1
  Mg  Mg16  1  0.933626  0.364196  0.655233  1
  Mg  Mg17  1  0.590425  0.678041  0.696447  1
  Mg  Mg18  1  0.322564  0.141977  0.704329  1
