# generated using pymatgen
data_Th14Tc4PdRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.96962746
_cell_length_b   9.95376013
_cell_length_c   6.36559810
_cell_angle_alpha   90.12946351
_cell_angle_beta   89.69800123
_cell_angle_gamma   119.91990442
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th14Tc4PdRu
_chemical_formula_sum   'Th14 Tc4 Pd1 Ru1'
_cell_volume   547.49458404
_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  0.46818174  0.54295140  0.29823034  1.0
  Th  Th1  1  0.07432066  0.54308954  0.29670266  1.0
  Th  Th2  1  0.91904030  0.46153112  0.80088121  1.0
  Th  Th3  1  0.25788536  0.12146446  0.50477526  1.0
  Th  Th4  1  0.54226274  0.08205213  0.80075821  1.0
  Th  Th5  1  0.75218391  0.87660536  0.00368560  1.0
  Th  Th6  1  0.66699769  0.33279731  0.28161831  1.0
  Th  Th7  1  0.12480856  0.87628292  0.00238646  1.0
  Th  Th8  1  0.45889028  0.91872841  0.29863019  1.0
  Th  Th9  1  0.54308490  0.46358624  0.80086608  1.0
  Th  Th10  1  0.86437674  0.11820914  0.50646130  1.0
  Th  Th11  1  0.12316644  0.24620110  0.01140433  1.0
  Th  Th12  1  0.87568912  0.75262164  0.50431755  1.0
  Th  Th13  1  0.33581700  0.67275093  0.79550623  1.0
  Tc  Tc14  1  0.81715925  0.63114235  0.04561407  1.0
  Tc  Tc15  1  0.82084574  0.18729429  0.04609018  1.0
  Tc  Tc16  1  0.62229650  0.80639403  0.54561949  1.0
  Tc  Tc17  1  0.36676541  0.18584167  0.04347525  1.0
  Pd  Pd18  1  0.18475589  0.37345543  0.55531077  1.0
  Ru  Ru19  1  0.18147275  0.80700153  0.54166451  1.0