# generated using pymatgen
data_Sm4MgRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.84711257
_cell_length_b   9.84717380
_cell_length_c   9.84705112
_cell_angle_alpha   60.00085372
_cell_angle_beta   60.00040201
_cell_angle_gamma   60.00082103
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm4MgRu
_chemical_formula_sum   'Sm16 Mg4 Ru4'
_cell_volume   675.17836340
_cell_formula_units_Z   4
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
  Sm  Sm0  1  0.93801633  0.56198938  0.56197441  1.0
  Sm  Sm1  1  0.56197842  0.93802549  0.93801650  1.0
  Sm  Sm2  1  0.56198734  0.93801941  0.56197740  1.0
  Sm  Sm3  1  0.93802256  0.56198037  0.93802075  1.0
  Sm  Sm4  1  0.56197670  0.56198141  0.93801794  1.0
  Sm  Sm5  1  0.93801534  0.93802210  0.56197552  1.0
  Sm  Sm6  1  0.81208682  0.18791780  0.18791110  1.0
  Sm  Sm7  1  0.18791530  0.81206595  0.81210472  1.0
  Sm  Sm8  1  0.18791524  0.81208152  0.18791078  1.0
  Sm  Sm9  1  0.81207110  0.18791778  0.81209713  1.0
  Sm  Sm10  1  0.18791435  0.18791720  0.81209841  1.0
  Sm  Sm11  1  0.81209355  0.81208074  0.18791147  1.0
  Sm  Sm12  1  0.34369733  0.34369916  0.34368478  1.0
  Sm  Sm13  1  0.34369127  0.34369317  0.96892352  1.0
  Sm  Sm14  1  0.34369985  0.96891261  0.34368684  1.0
  Sm  Sm15  1  0.96891659  0.34369996  0.34368532  1.0
  Mg  Mg16  1  0.57840010  0.57840188  0.57839834  1.0
  Mg  Mg17  1  0.57840069  0.57840226  0.26479535  1.0
  Mg  Mg18  1  0.57839874  0.26480373  0.57839713  1.0
  Mg  Mg19  1  0.26480025  0.57840105  0.57839776  1.0
  Ru  Ru20  1  0.13779611  0.13779207  0.13779748  1.0
  Ru  Ru21  1  0.13779549  0.13779407  0.58661493  1.0
  Ru  Ru22  1  0.13779592  0.58660618  0.13780274  1.0
  Ru  Ru23  1  0.58661360  0.13779273  0.13779767  1.0