# generated using pymatgen
data_Th8Ni6IrOs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.26012544
_cell_length_b   5.79437073
_cell_length_c   14.29573082
_cell_angle_alpha   89.92857587
_cell_angle_beta   89.99997081
_cell_angle_gamma   89.99997652
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th8Ni6IrOs
_chemical_formula_sum   'Th8 Ni6 Ir1 Os1'
_cell_volume   352.88621246
_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
  Th  Th0  1  0.25000000  0.55095508  0.28356443  1.0
  Th  Th1  1  0.75000000  0.44620348  0.71732071  1.0
  Th  Th2  1  0.25000000  0.94480507  0.78341397  1.0
  Th  Th3  1  0.24999900  0.76393793  0.53764595  1.0
  Th  Th4  1  0.25000000  0.74438058  0.03160729  1.0
  Th  Th5  1  0.75000100  0.26436669  0.96349811  1.0
  Th  Th6  1  0.75000000  0.05129936  0.21341511  1.0
  Th  Th7  1  0.75000000  0.24601550  0.46980430  1.0
  Ni  Ni8  1  0.75000000  0.73189869  0.40719466  1.0
  Ni  Ni9  1  0.24999900  0.45027443  0.85324278  1.0
  Ni  Ni10  1  0.75000000  0.95833330  0.64629246  1.0
  Ni  Ni11  1  0.75000000  0.74992707  0.89195381  1.0
  Ni  Ni12  1  0.25000100  0.23330168  0.09317842  1.0
  Ni  Ni13  1  0.24999900  0.25183414  0.60733412  1.0
  Ir  Ir14  1  0.25000000  0.05425025  0.35473803  1.0
  Os  Os15  1  0.75000000  0.55821774  0.14579486  1.0