# generated using pymatgen
data_Zr18Ta5(RuO2)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.71934659
_cell_length_b   8.64897039
_cell_length_c   8.58622281
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.78579971
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr18Ta5(RuO2)3
_chemical_formula_sum   'Zr18 Ta5 Ru3 O6'
_cell_volume   556.27243479
_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  0.45281282  0.90858985  0.25000000  1.0
  Zr  Zr1  1  0.54532198  0.09322200  0.75000000  1.0
  Zr  Zr2  1  0.09364634  0.54674155  0.25000000  1.0
  Zr  Zr3  1  0.90633462  0.45397172  0.75000000  1.0
  Zr  Zr4  1  0.45400354  0.54720856  0.25000000  1.0
  Zr  Zr5  1  0.54714841  0.45559155  0.75000000  1.0
  Zr  Zr6  1  0.20685084  0.41192028  0.56533642  1.0
  Zr  Zr7  1  0.79395608  0.58596142  0.43596166  1.0
  Zr  Zr8  1  0.58718977  0.79439815  0.56284459  1.0
  Zr  Zr9  1  0.79395608  0.58596142  0.06403834  1.0
  Zr  Zr10  1  0.41383809  0.20757956  0.43957239  1.0
  Zr  Zr11  1  0.20685084  0.41192028  0.93466358  1.0
  Zr  Zr12  1  0.20619120  0.79444683  0.55951925  1.0
  Zr  Zr13  1  0.41383809  0.20757956  0.06042761  1.0
  Zr  Zr14  1  0.79629550  0.20502940  0.43851196  1.0
  Zr  Zr15  1  0.58718977  0.79439815  0.93715541  1.0
  Zr  Zr16  1  0.79629550  0.20502940  0.06148804  1.0
  Zr  Zr17  1  0.20619120  0.79444683  0.94048075  1.0
  Ta  Ta18  1  0.21841320  0.10430930  0.75000000  1.0
  Ta  Ta19  1  0.11003152  0.88972353  0.25000000  1.0
  Ta  Ta20  1  0.88550623  0.10561983  0.75000000  1.0
  Ta  Ta21  1  0.99439145  0.99919559  0.00741460  1.0
  Ta  Ta22  1  0.99439145  0.99919559  0.49258540  1.0
  Ru  Ru23  1  0.11379454  0.22750894  0.25000000  1.0
  Ru  Ru24  1  0.88942738  0.77779967  0.75000000  1.0
  Ru  Ru25  1  0.77524327  0.88738022  0.25000000  1.0
  O  O26  1  0.50269147  0.99898839  0.00136982  1.0
  O  O27  1  0.99885351  0.49980082  0.00022213  1.0
  O  O28  1  0.50269147  0.99898839  0.49863018  1.0
  O  O29  1  0.50390016  0.50384568  0.00179496  1.0
  O  O30  1  0.99885351  0.49980082  0.49977787  1.0
  O  O31  1  0.50390016  0.50384568  0.49820504  1.0