# generated using pymatgen
data_Mg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.35327386
_cell_length_b   11.45389863
_cell_length_c   45.56949577
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg
_chemical_formula_sum   Mg108
_cell_volume   5403.87457142
_cell_formula_units_Z   108
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  0.999245  0.465253  0.315916  1
  Mg  Mg2  1  0.999290  0.195227  0.299731  1
  Mg  Mg3  1  0.004088  0.926839  0.284083  1
  Mg  Mg4  1  0.251046  0.310669  0.326374  1
  Mg  Mg5  1  0.251046  0.043171  0.310106  1
  Mg  Mg6  1  0.251046  0.777437  0.294664  1
  Mg  Mg7  1  0.502847  0.465253  0.315916  1
  Mg  Mg8  1  0.502802  0.195227  0.299731  1
  Mg  Mg9  1  0.498004  0.926839  0.284083  1
  Mg  Mg10  1  0.751046  0.351539  0.289478  1
  Mg  Mg11  1  0.751046  0.889991  0.321056  1
  Mg  Mg12  1  0.751046  0.620457  0.305390  1
  Mg  Mg13  1  1.000730  0.272910  0.364709  1
  Mg  Mg14  1  0.002251  0.003598  0.348709  1
  Mg  Mg15  1  1.000856  0.734961  0.332123  1
  Mg  Mg16  1  0.251046  0.119565  0.375779  1
  Mg  Mg17  1  0.251046  0.850389  0.359334  1
  Mg  Mg18  1  0.251046  0.580610  0.342886  1
  Mg  Mg19  1  0.501362  0.272910  0.364709  1
  Mg  Mg20  1  0.499841  0.003598  0.348709  1
  Mg  Mg21  1  0.501236  0.734961  0.332123  1
  Mg  Mg22  1  0.751046  0.157079  0.337117  1
  Mg  Mg23  1  0.751046  0.696287  0.370416  1
  Mg  Mg24  1  0.751046  0.426974  0.353955  1
  Mg  Mg25  1  0.001057  0.080758  0.415064  1
  Mg  Mg26  1  1.001028  0.811007  0.398226  1
  Mg  Mg27  1  1.000905  0.541877  0.381476  1
  Mg  Mg28  1  0.251046  0.926816  0.426173  1
  Mg  Mg29  1  0.251046  0.657367  0.409202  1
  Mg  Mg30  1  0.251046  0.388070  0.392375  1
  Mg  Mg31  1  0.501036  0.080758  0.415064  1
  Mg  Mg32  1  0.501064  0.811007  0.398226  1
  Mg  Mg33  1  0.501187  0.541877  0.381476  1
  Mg  Mg34  1  0.751046  0.965060  0.386969  1
  Mg  Mg35  1  0.751046  0.504051  0.420599  1
  Mg  Mg36  1  0.751046  0.234283  0.403554  1
  Mg  Mg37  1  1.001044  0.888573  0.465372  1
  Mg  Mg38  1  0.001144  0.619232  0.448545  1
  Mg  Mg39  1  0.001048  0.349932  0.431688  1
  Mg  Mg40  1  0.251046  0.734581  0.476471  1
  Mg  Mg41  1  0.251046  0.465265  0.459605  1
  Mg  Mg42  1  0.251046  0.196095  0.442874  1
  Mg  Mg43  1  0.501048  0.888573  0.465372  1
  Mg  Mg44  1  0.500948  0.619232  0.448545  1
  Mg  Mg45  1  0.501044  0.349932  0.431688  1
  Mg  Mg46  1  0.751046  0.773308  0.437373  1
  Mg  Mg47  1  0.751046  0.311738  0.470809  1
  Mg  Mg48  1  0.751046  0.042518  0.454060  1
  Mg  Mg49  1  0.001050  0.696301  0.515699  1
  Mg  Mg50  1  1.001026  0.427003  0.498890  1
  Mg  Mg51  1  0.001066  0.157841  0.482147  1
  Mg  Mg52  1  0.251046  0.542290  0.526787  1
  Mg  Mg53  1  0.251046  0.273097  0.510012  1
  Mg  Mg54  1  0.251046  0.003903  0.493312  1
  Mg  Mg55  1  0.501042  0.696301  0.515699  1
  Mg  Mg56  1  0.501066  0.427003  0.498890  1
  Mg  Mg57  1  0.501026  0.157841  0.482147  1
  Mg  Mg58  1  0.751046  0.581095  0.487710  1
  Mg  Mg59  1  0.751046  0.119435  0.521164  1
  Mg  Mg60  1  0.751046  0.850356  0.504504  1
  Mg  Mg61  1  1.000955  0.504066  0.566078  1
  Mg  Mg62  1  0.001063  0.234745  0.549284  1
  Mg  Mg63  1  1.001011  0.965629  0.532569  1
  Mg  Mg64  1  0.251046  0.350135  0.577071  1
  Mg  Mg65  1  0.251046  0.080909  0.560429  1
  Mg  Mg66  1  0.251046  0.811668  0.543620  1
  Mg  Mg67  1  0.501137  0.504066  0.566078  1
  Mg  Mg68  1  0.501029  0.234745  0.549284  1
  Mg  Mg69  1  0.501081  0.965629  0.532569  1
  Mg  Mg70  1  0.751046  0.388783  0.538021  1
  Mg  Mg71  1  0.751046  0.927399  0.571705  1
  Mg  Mg72  1  0.751046  0.658186  0.554876  1
  Mg  Mg73  1  0.001409  0.312092  0.616375  1
  Mg  Mg74  1  1.000955  0.043001  0.599883  1
  Mg  Mg75  1  1.001020  0.773418  0.582873  1
  Mg  Mg76  1  0.251046  0.158270  0.627379  1
  Mg  Mg77  1  0.251046  0.889312  0.610715  1
  Mg  Mg78  1  0.251046  0.619628  0.593839  1
  Mg  Mg79  1  0.500683  0.312092  0.616375  1
  Mg  Mg80  1  0.501137  0.043001  0.599883  1
  Mg  Mg81  1  0.501072  0.773418  0.582873  1
  Mg  Mg82  1  0.751046  0.196397  0.588192  1
  Mg  Mg83  1  0.751046  0.735075  0.622101  1
  Mg  Mg84  1  0.751046  0.466147  0.605228  1
  Mg  Mg85  1  0.999714  0.119878  0.666325  1
  Mg  Mg86  1  1.001013  0.850104  0.649691  1
  Mg  Mg87  1  0.001232  0.581061  0.633163  1
  Mg  Mg88  1  0.251046  0.965058  0.676713  1
  Mg  Mg89  1  0.251046  0.697141  0.660314  1
  Mg  Mg90  1  0.251046  0.427633  0.643760  1
  Mg  Mg91  1  0.502379  0.119878  0.666325  1
  Mg  Mg92  1  0.501079  0.850104  0.649691  1
  Mg  Mg93  1  0.500860  0.581061  0.633163  1
  Mg  Mg94  1  0.751046  0.003853  0.638753  1
  Mg  Mg95  1  0.751046  0.542395  0.671511  1
  Mg  Mg96  1  0.751046  0.273188  0.654329  1
  Mg  Mg97  1  0.002562  0.924847  0.714431  1
  Mg  Mg98  1  0.002332  0.657508  0.698595  1
  Mg  Mg99  1  0.001300  0.388374  0.682242  1
  Mg  Mg100  1  0.251046  0.773338  0.724837  1
  Mg  Mg101  1  0.251046  0.506417  0.708334  1
  Mg  Mg102  1  0.251046  0.235344  0.692233  1
  Mg  Mg103  1  0.499530  0.924847  0.714431  1
  Mg  Mg104  1  0.499760  0.657508  0.698595  1
  Mg  Mg105  1  0.500792  0.388374  0.682242  1
  Mg  Mg106  1  0.751046  0.812145  0.687997  1
  Mg  Mg107  1  0.751046  0.345772  0.718851  1
  Mg  Mg108  1  0.751046  0.078755  0.703958  1
