# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.41150272
_cell_length_b   6.07292830
_cell_length_c   48.28396643
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   95.68927837
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg
_chemical_formula_sum   Mg48
_cell_volume   2454.31398555
_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  0.407638  0.727690  0.316971  1
  Mg  Mg2  1  0.709094  0.884221  0.283031  1
  Mg  Mg3  1  0.061840  0.807164  0.298543  1
  Mg  Mg4  1  0.516963  0.243812  0.312528  1
  Mg  Mg5  1  0.867119  0.152958  0.332191  1
  Mg  Mg6  1  0.162043  0.320654  0.295024  1
  Mg  Mg7  1  0.464678  0.457258  0.371496  1
  Mg  Mg8  1  0.764796  0.630628  0.335816  1
  Mg  Mg9  1  0.114397  0.546936  0.353923  1
  Mg  Mg10  1  0.570288  0.972667  0.368425  1
  Mg  Mg11  1  0.921274  0.882945  0.387294  1
  Mg  Mg12  1  0.217812  0.062651  0.350587  1
  Mg  Mg13  1  0.516317  0.190110  0.427530  1
  Mg  Mg14  1  0.814908  0.367002  0.390842  1
  Mg  Mg15  1  0.165897  0.278917  0.409184  1
  Mg  Mg16  1  0.623401  0.704938  0.424408  1
  Mg  Mg17  1  0.974686  0.615565  0.443192  1
  Mg  Mg18  1  0.273170  0.793848  0.405996  1
  Mg  Mg19  1  0.568724  0.921924  0.483391  1
  Mg  Mg20  1  0.867230  0.099955  0.446308  1
  Mg  Mg21  1  0.218138  0.010993  0.464899  1
  Mg  Mg22  1  0.676225  0.436715  0.480306  1
  Mg  Mg23  1  0.027114  0.347287  0.498941  1
  Mg  Mg24  1  0.325587  0.525844  0.461805  1
  Mg  Mg25  1  0.621090  0.653857  0.539213  1
  Mg  Mg26  1  0.919562  0.832414  0.502078  1
  Mg  Mg27  1  0.270452  0.742985  0.520713  1
  Mg  Mg28  1  0.728539  0.168707  0.536119  1
  Mg  Mg29  1  0.079446  0.079746  0.554711  1
  Mg  Mg30  1  0.377953  0.257776  0.517628  1
  Mg  Mg31  1  0.673507  0.385853  0.595022  1
  Mg  Mg32  1  0.971990  0.564136  0.557827  1
  Mg  Mg33  1  0.323275  0.474763  0.576611  1
  Mg  Mg34  1  0.780779  0.900784  0.591835  1
  Mg  Mg35  1  0.131769  0.812698  0.610176  1
  Mg  Mg36  1  0.430360  0.989590  0.573488  1
  Mg  Mg37  1  0.728865  0.117050  0.650431  1
  Mg  Mg38  1  0.025403  0.296756  0.613724  1
  Mg  Mg39  1  0.376389  0.207034  0.632594  1
  Mg  Mg40  1  0.832279  0.632764  0.647095  1
  Mg  Mg41  1  0.181880  0.549073  0.665203  1
  Mg  Mg42  1  0.481998  0.722443  0.629522  1
  Mg  Mg43  1  0.784633  0.859047  0.705995  1
  Mg  Mg44  1  0.079557  0.026743  0.668828  1
  Mg  Mg45  1  0.429714  0.935889  0.688491  1
  Mg  Mg46  1  0.884837  0.372537  0.702475  1
  Mg  Mg47  1  0.237583  0.295480  0.717987  1
  Mg  Mg48  1  0.539038  0.452011  0.684048  1
