# generated using pymatgen
data_Hf18Nb5(TcO2)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.56732387
_cell_length_b   8.61515081
_cell_length_c   8.41034831
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.49174819
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf18Nb5(TcO2)3
_chemical_formula_sum   'Hf18 Nb5 Tc3 O6'
_cell_volume   540.32393838
_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
  Hf  Hf0  1  0.45297939  0.90722737  0.25000000  1.0
  Hf  Hf1  1  0.54668499  0.09392953  0.75000000  1.0
  Hf  Hf2  1  0.09440791  0.54816674  0.25000000  1.0
  Hf  Hf3  1  0.90651714  0.45288763  0.75000000  1.0
  Hf  Hf4  1  0.45303489  0.54742026  0.25000000  1.0
  Hf  Hf5  1  0.54635029  0.45230204  0.75000000  1.0
  Hf  Hf6  1  0.20453676  0.40979618  0.56445291  1.0
  Hf  Hf7  1  0.79295045  0.58555005  0.43679337  1.0
  Hf  Hf8  1  0.58383312  0.79293529  0.56411188  1.0
  Hf  Hf9  1  0.79295045  0.58555005  0.06320663  1.0
  Hf  Hf10  1  0.41160230  0.20533023  0.43758821  1.0
  Hf  Hf11  1  0.20453676  0.40979618  0.93554709  1.0
  Hf  Hf12  1  0.20659866  0.79370026  0.56275906  1.0
  Hf  Hf13  1  0.41160230  0.20533023  0.06241179  1.0
  Hf  Hf14  1  0.79201412  0.20675059  0.43740088  1.0
  Hf  Hf15  1  0.58383312  0.79293529  0.93588812  1.0
  Hf  Hf16  1  0.79201412  0.20675059  0.06259912  1.0
  Hf  Hf17  1  0.20659866  0.79370026  0.93724094  1.0
  Nb  Nb18  1  0.11442392  0.22223472  0.25000000  1.0
  Nb  Nb19  1  0.88966638  0.78021624  0.75000000  1.0
  Nb  Nb20  1  0.77791549  0.88455775  0.25000000  1.0
  Nb  Nb21  1  0.00338178  0.00247985  0.99586100  1.0
  Nb  Nb22  1  0.00338178  0.00247985  0.50413900  1.0
  Tc  Tc23  1  0.22898547  0.11737340  0.75000000  1.0
  Tc  Tc24  1  0.11589881  0.88454380  0.25000000  1.0
  Tc  Tc25  1  0.88777292  0.11830713  0.75000000  1.0
  O  O26  1  0.49824274  0.00016430  0.99862267  1.0
  O  O27  1  0.00110406  0.50086715  0.99966051  1.0
  O  O28  1  0.49824274  0.00016430  0.50137733  1.0
  O  O29  1  0.49841720  0.49784128  0.99876359  1.0
  O  O30  1  0.00110406  0.50086715  0.50033949  1.0
  O  O31  1  0.49841720  0.49784128  0.50123641  1.0