# generated using pymatgen
data_MgSc8Ir4Ru3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.46954928
_cell_length_b   4.56260015
_cell_length_c   9.18180004
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00038520
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgSc8Ir4Ru3
_chemical_formula_sum   'Mg1 Sc8 Ir4 Ru3'
_cell_volume   271.02806626
_cell_formula_units_Z   1
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  Mg0  1  0.24996045  0.25000000  0.12495660  1.0
  Sc  Sc1  1  0.98493201  0.75000000  0.12495273  1.0
  Sc  Sc2  1  0.51496698  0.75000000  0.12496427  1.0
  Sc  Sc3  1  0.99431498  0.25000000  0.38417744  1.0
  Sc  Sc4  1  0.50558713  0.25000000  0.38420053  1.0
  Sc  Sc5  1  0.49805960  0.75000000  0.62504599  1.0
  Sc  Sc6  1  0.00206729  0.75000000  0.62503585  1.0
  Sc  Sc7  1  0.50569720  0.25000000  0.86581929  1.0
  Sc  Sc8  1  0.99439190  0.25000000  0.86579906  1.0
  Ir  Ir9  1  0.74995336  0.25000000  0.12496522  1.0
  Ir  Ir10  1  0.24997470  0.75000000  0.36889692  1.0
  Ir  Ir11  1  0.75003870  0.25000000  0.62502824  1.0
  Ir  Ir12  1  0.25002412  0.75000000  0.88110514  1.0
  Ru  Ru13  1  0.74997015  0.75000000  0.37598329  1.0
  Ru  Ru14  1  0.25003363  0.25000000  0.62504582  1.0
  Ru  Ru15  1  0.75002881  0.75000000  0.87402060  1.0