# generated using pymatgen
data_Sc10As4IrRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.81531528
_cell_length_b   7.82644036
_cell_length_c   7.96149800
_cell_angle_alpha   119.44040976
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc10As4IrRu
_chemical_formula_sum   'Sc10 As4 Ir1 Ru1'
_cell_volume   315.56174785
_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
  Sc  Sc0  1  0.00004165  0.66178436  0.32408451  1.0
  Sc  Sc1  1  0.00004165  0.33769884  0.67591549  1.0
  Sc  Sc2  1  0.49995835  0.33769884  0.67591549  1.0
  Sc  Sc3  1  0.49995835  0.66178436  0.32408451  1.0
  Sc  Sc4  1  0.75000000  0.74678487  0.76711898  1.0
  Sc  Sc5  1  0.25000000  0.25471132  0.23141677  1.0
  Sc  Sc6  1  0.75000000  0.97966689  0.23288102  1.0
  Sc  Sc7  1  0.25000000  0.02329255  0.76858323  1.0
  Sc  Sc8  1  0.75000000  0.24710534  0.00000000  1.0
  Sc  Sc9  1  0.25000000  0.74934758  1.00000000  1.0
  As  As10  1  0.75000000  0.37892189  0.38828298  1.0
  As  As11  1  0.25000000  0.62153042  0.61267351  1.0
  As  As12  1  0.75000000  0.99063891  0.61171702  1.0
  As  As13  1  0.25000000  0.00885691  0.38732649  1.0
  Ir  Ir14  1  0.75000000  0.59168915  0.00000000  1.0
  Ru  Ru15  1  0.25000000  0.40848576  0.00000000  1.0