# generated using pymatgen
data_ZrSc5(AsRu)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.66519241
_cell_length_b   7.66561369
_cell_length_c   7.66519173
_cell_angle_alpha   128.09225602
_cell_angle_beta   121.10507403
_cell_angle_gamma   82.32433904
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrSc5(AsRu)6
_chemical_formula_sum   'Zr1 Sc5 As6 Ru6'
_cell_volume   291.82320471
_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
  Zr  Zr0  1  0.94678349  0.64845555  0.20167206  1.0
  Sc  Sc1  1  0.46865545  0.69517066  0.72651622  1.0
  Sc  Sc2  1  0.53212997  0.25830611  0.22617714  1.0
  Sc  Sc3  1  0.74951266  0.83706254  0.58755088  1.0
  Sc  Sc4  1  0.25056394  0.83860327  0.08803833  1.0
  Sc  Sc5  1  0.05184597  0.25481039  0.70296442  1.0
  As  As6  1  0.27238611  0.27341523  0.50102913  1.0
  As  As7  1  0.72432358  0.21652346  0.99219988  1.0
  As  As8  1  0.33239444  0.58654571  0.25056415  1.0
  As  As9  1  0.66870957  0.92255276  0.25784975  1.0
  As  As10  1  0.16470301  0.92255276  0.75384119  1.0
  As  As11  1  0.83598156  0.58654571  0.75415127  1.0
  Ru  Ru12  1  0.50521873  0.49612030  0.99918823  1.0
  Ru  Ru13  1  0.99693206  0.49612030  0.49090157  1.0
  Ru  Ru14  1  0.09790473  0.25476163  0.10855005  1.0
  Ru  Ru15  1  0.90592883  0.00864649  0.15883117  1.0
  Ru  Ru16  1  0.34981532  0.00864649  0.60271766  1.0
  Ru  Ru17  1  0.64621258  0.25476163  0.65685690  1.0