# generated using pymatgen
data_Sc4As6Ir3Ru4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.03710989
_cell_length_b   7.04804106
_cell_length_c   7.04804090
_cell_angle_alpha   109.50261023
_cell_angle_beta   109.43980980
_cell_angle_gamma   109.43980153
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc4As6Ir3Ru4
_chemical_formula_sum   'Sc4 As6 Ir3 Ru4'
_cell_volume   269.20154711
_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  0.00040856  0.00081712  0.50040856  1.0
  Sc  Sc1  1  0.50000000  0.00000000  0.00000000  1.0
  Sc  Sc2  1  0.99959144  0.49959144  0.99918288  1.0
  Sc  Sc3  1  0.50000000  0.49959144  0.50040856  1.0
  As  As4  1  0.68273661  0.68249116  0.99356810  1.0
  As  As5  1  0.31083049  0.31107494  0.99356810  1.0
  As  As6  1  0.99975555  0.68249116  0.68892506  1.0
  As  As7  1  0.00024445  0.31107494  0.31750884  1.0
  As  As8  1  0.68916951  0.00643190  0.68892506  1.0
  As  As9  1  0.31726339  0.00643190  0.31750884  1.0
  Ir  Ir10  1  0.50000000  0.75091823  0.24908177  1.0
  Ir  Ir11  1  0.74908177  0.49816254  0.24908177  1.0
  Ir  Ir12  1  0.25091823  0.75091823  0.50183746  1.0
  Ru  Ru13  1  0.00000000  0.00000000  0.00000000  1.0
  Ru  Ru14  1  0.24968976  0.49938052  0.74968976  1.0
  Ru  Ru15  1  0.75031024  0.25031024  0.50061948  1.0
  Ru  Ru16  1  0.50000000  0.25031024  0.74968976  1.0