# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.17665972
_cell_length_b   20.96359096
_cell_length_c   49.00909736
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   94.34632970
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg
_chemical_formula_sum   Mg64
_cell_volume   3254.33550662
_cell_formula_units_Z   64
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  0.426014  0.913049  0.283756  1
  Mg  Mg2  1  0.671069  0.403126  0.310864  1
  Mg  Mg3  1  0.112790  0.286572  0.286093  1
  Mg  Mg4  1  0.359112  0.779213  0.313098  1
  Mg  Mg5  1  0.548965  0.158930  0.297093  1
  Mg  Mg6  1  0.794729  0.650446  0.324780  1
  Mg  Mg7  1  0.984444  0.029898  0.308289  1
  Mg  Mg8  1  0.230099  0.521187  0.335883  1
  Mg  Mg9  1  0.917304  0.895612  0.338270  1
  Mg  Mg10  1  0.162954  0.386900  0.365709  1
  Mg  Mg11  1  0.604347  0.269688  0.340577  1
  Mg  Mg12  1  0.850121  0.761232  0.368010  1
  Mg  Mg13  1  0.040118  0.141236  0.351873  1
  Mg  Mg14  1  0.285794  0.632579  0.379581  1
  Mg  Mg15  1  0.475831  0.012665  0.363343  1
  Mg  Mg16  1  0.721509  0.504010  0.391041  1
  Mg  Mg17  1  0.408569  0.878138  0.393684  1
  Mg  Mg18  1  0.654317  0.369630  0.421360  1
  Mg  Mg19  1  0.095747  0.252488  0.395985  1
  Mg  Mg20  1  0.341383  0.743760  0.423663  1
  Mg  Mg21  1  0.531418  0.123835  0.407497  1
  Mg  Mg22  1  0.777088  0.615169  0.435260  1
  Mg  Mg23  1  0.967104  0.995210  0.419087  1
  Mg  Mg24  1  0.212824  0.486643  0.446843  1
  Mg  Mg25  1  0.899887  0.860773  0.449400  1
  Mg  Mg26  1  0.145624  0.352245  0.477119  1
  Mg  Mg27  1  0.587076  0.235147  0.451654  1
  Mg  Mg28  1  0.832743  0.726481  0.479440  1
  Mg  Mg29  1  0.022751  0.106500  0.463246  1
  Mg  Mg30  1  0.268459  0.597912  0.491040  1
  Mg  Mg31  1  0.458436  0.977874  0.474873  1
  Mg  Mg32  1  0.704164  0.469325  0.502627  1
  Mg  Mg33  1  0.391246  0.843492  0.505199  1
  Mg  Mg34  1  0.636948  0.334894  0.532877  1
  Mg  Mg35  1  0.078405  0.217807  0.507391  1
  Mg  Mg36  1  0.324122  0.709239  0.535225  1
  Mg  Mg37  1  0.514095  0.089189  0.519011  1
  Mg  Mg38  1  0.759827  0.580649  0.546816  1
  Mg  Mg39  1  0.949794  0.960590  0.530645  1
  Mg  Mg40  1  0.195502  0.452001  0.558365  1
  Mg  Mg41  1  0.882604  0.826208  0.561050  1
  Mg  Mg42  1  0.128259  0.317518  0.588622  1
  Mg  Mg43  1  0.569731  0.200462  0.563161  1
  Mg  Mg44  1  0.815513  0.692019  0.590987  1
  Mg  Mg45  1  0.005447  0.071896  0.574778  1
  Mg  Mg46  1  0.251176  0.563347  0.602555  1
  Mg  Mg47  1  0.441140  0.943283  0.586367  1
  Mg  Mg48  1  0.686841  0.434680  0.614028  1
  Mg  Mg49  1  0.373929  0.808861  0.616948  1
  Mg  Mg50  1  0.619678  0.300356  0.644252  1
  Mg  Mg51  1  0.061075  0.183151  0.618933  1
  Mg  Mg52  1  0.306754  0.674499  0.646549  1
  Mg  Mg53  1  0.496788  0.054580  0.630419  1
  Mg  Mg54  1  0.742435  0.545862  0.658148  1
  Mg  Mg55  1  0.932509  0.926023  0.641846  1
  Mg  Mg56  1  0.178218  0.417433  0.669474  1
  Mg  Mg57  1  0.865317  0.791638  0.672326  1
  Mg  Mg58  1  0.111462  0.283927  0.699097  1
  Mg  Mg59  1  0.552636  0.166275  0.674026  1
  Mg  Mg60  1  0.797320  0.655613  0.701287  1
  Mg  Mg61  1  0.988237  0.037480  0.685165  1
  Mg  Mg62  1  0.233258  0.527505  0.713010  1
  Mg  Mg63  1  0.424585  0.910178  0.696240  1
  Mg  Mg64  1  0.669532  0.400063  0.724009  1
