# generated using pymatgen
data_Ho7Th13(Ir2Ru)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.19782414
_cell_length_b   11.11323919
_cell_length_c   6.37795449
_cell_angle_alpha   89.57321360
_cell_angle_beta   89.97675285
_cell_angle_gamma   89.82382952
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ho7Th13(Ir2Ru)4
_chemical_formula_sum   'Ho7 Th13 Ir8 Ru4'
_cell_volume   793.67296469
_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
  Ho  Ho0  1  0.91246432  0.28455809  0.60704807  1.0
  Ho  Ho1  1  0.08933126  0.71292549  0.60958323  1.0
  Ho  Ho2  1  0.08708494  0.28761492  0.10816221  1.0
  Ho  Ho3  1  0.99946474  0.99916302  0.49454881  1.0
  Ho  Ho4  1  0.00165967  0.00424394  0.99297669  1.0
  Ho  Ho5  1  0.50373361  0.49937782  0.01746797  1.0
  Ho  Ho6  1  0.49791174  0.50043064  0.51693143  1.0
  Th  Th7  1  0.28762602  0.09231885  0.38553014  1.0
  Th  Th8  1  0.28980864  0.90965640  0.88517629  1.0
  Th  Th9  1  0.70913995  0.09106747  0.88718421  1.0
  Th  Th10  1  0.71156576  0.91067388  0.38901113  1.0
  Th  Th11  1  0.59104362  0.78816920  0.89020699  1.0
  Th  Th12  1  0.58845550  0.21298771  0.38997023  1.0
  Th  Th13  1  0.41028857  0.78960285  0.38911742  1.0
  Th  Th14  1  0.40665846  0.21415995  0.88951417  1.0
  Th  Th15  1  0.19682829  0.41097966  0.60843059  1.0
  Th  Th16  1  0.20758276  0.58707728  0.10839376  1.0
  Th  Th17  1  0.79958117  0.40374101  0.10930219  1.0
  Th  Th18  1  0.79770063  0.58380672  0.61102053  1.0
  Th  Th19  1  0.91598950  0.71113523  0.10999624  1.0
  Ir  Ir20  1  0.84487746  0.14984135  0.24374428  1.0
  Ir  Ir21  1  0.84709862  0.84639326  0.75081430  1.0
  Ir  Ir22  1  0.15249623  0.15336220  0.74043687  1.0
  Ir  Ir23  1  0.15409950  0.84665943  0.24067002  1.0
  Ir  Ir24  1  0.65338487  0.34367539  0.75971421  1.0
  Ir  Ir25  1  0.65427482  0.65599653  0.26048345  1.0
  Ir  Ir26  1  0.34450564  0.34564093  0.26039518  1.0
  Ir  Ir27  1  0.34914710  0.65719094  0.76076947  1.0
  Ru  Ru28  1  0.49794185  0.00083428  0.12105970  1.0
  Ru  Ru29  1  0.50009795  0.00086992  0.62056060  1.0
  Ru  Ru30  1  0.00017224  0.50202691  0.87284339  1.0
  Ru  Ru31  1  0.99798355  0.50381970  0.36893924  1.0