# generated using pymatgen
data_Sc6ZnAs5Ru6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.68543047
_cell_length_b   7.69360723
_cell_length_c   7.68543068
_cell_angle_alpha   127.89572666
_cell_angle_beta   122.63208696
_cell_angle_gamma   81.14359565
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc6ZnAs5Ru6
_chemical_formula_sum   'Sc6 Zn1 As5 Ru6'
_cell_volume   291.05757003
_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  0.45453354  0.66591336  0.71138081  1.0
  Sc  Sc1  1  0.53765728  0.25337650  0.21571923  1.0
  Sc  Sc2  1  0.74803823  0.84301421  0.59497598  1.0
  Sc  Sc3  1  0.25027792  0.85054150  0.10026259  1.0
  Sc  Sc4  1  0.05735307  0.25435130  0.69699823  1.0
  Sc  Sc5  1  0.95131489  0.65618333  0.20486844  1.0
  Zn  Zn6  1  0.26328180  0.26274016  0.49945936  1.0
  As  As7  1  0.73812205  0.24261846  0.00449641  1.0
  As  As8  1  0.33201063  0.58590267  0.25252752  1.0
  As  As9  1  0.66701145  0.92079487  0.25418713  1.0
  As  As10  1  0.16660673  0.92079487  0.75378242  1.0
  As  As11  1  0.83337515  0.58590267  0.75389104  1.0
  Ru  Ru12  1  0.50905174  0.50000902  0.00948962  1.0
  Ru  Ru13  1  0.99052040  0.50000902  0.49095928  1.0
  Ru  Ru14  1  0.09709838  0.25272487  0.10196182  1.0
  Ru  Ru15  1  0.88067747  0.00600016  0.13369294  1.0
  Ru  Ru16  1  0.37230722  0.00600016  0.62532270  1.0
  Ru  Ru17  1  0.65076206  0.25272487  0.65562549  1.0