# generated using pymatgen
data_FeTc6(NiO12)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.53103252
_cell_length_b   9.53103249
_cell_length_c   9.53103256
_cell_angle_alpha   56.04199675
_cell_angle_beta   56.04199809
_cell_angle_gamma   56.04199734
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeTc6(NiO12)2
_chemical_formula_sum   'Fe1 Tc6 Ni2 O24'
_cell_volume   556.08956936
_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
  Fe  Fe0  1  0.85431719  0.85431719  0.85431719  1.0
  Tc  Tc1  1  0.47673413  0.73599821  0.03617997  1.0
  Tc  Tc2  1  0.73599821  0.03617997  0.47673413  1.0
  Tc  Tc3  1  0.03617997  0.47673413  0.73599821  1.0
  Tc  Tc4  1  0.96099670  0.53488711  0.25476614  1.0
  Tc  Tc5  1  0.25476614  0.96099670  0.53488711  1.0
  Tc  Tc6  1  0.53488711  0.25476614  0.96099670  1.0
  Ni  Ni7  1  0.35912321  0.35912321  0.35912321  1.0
  Ni  Ni8  1  0.64204657  0.64204657  0.64204657  1.0
  O  O9  1  0.49439135  0.30426815  0.13168141  1.0
  O  O10  1  0.13168141  0.49439135  0.30426815  1.0
  O  O11  1  0.33466031  0.95113711  0.98869426  1.0
  O  O12  1  0.30426815  0.13168141  0.49439135  1.0
  O  O13  1  0.67672376  0.72250471  0.01625896  1.0
  O  O14  1  0.37702274  0.60264689  0.25023112  1.0
  O  O15  1  0.60264689  0.25023112  0.37702274  1.0
  O  O16  1  0.95113711  0.98869426  0.33466031  1.0
  O  O17  1  0.25023112  0.37702274  0.60264689  1.0
  O  O18  1  0.98303893  0.68287231  0.03234537  1.0
  O  O19  1  0.96832578  0.33807328  0.29049278  1.0
  O  O20  1  0.29049278  0.96832578  0.33807328  1.0
  O  O21  1  0.72250471  0.01625896  0.67672376  1.0
  O  O22  1  0.01625896  0.67672376  0.72250471  1.0
  O  O23  1  0.98869426  0.33466031  0.95113711  1.0
  O  O24  1  0.75469219  0.63382974  0.39599367  1.0
  O  O25  1  0.03234537  0.98303893  0.68287231  1.0
  O  O26  1  0.39599367  0.75469219  0.63382974  1.0
  O  O27  1  0.63382974  0.39599367  0.75469219  1.0
  O  O28  1  0.33807328  0.29049278  0.96832578  1.0
  O  O29  1  0.65572138  0.88400121  0.52770636  1.0
  O  O30  1  0.68287231  0.03234537  0.98303893  1.0
  O  O31  1  0.88400121  0.52770636  0.65572138  1.0
  O  O32  1  0.52770636  0.65572138  0.88400121  1.0