[CIF]
data_TlCr2FeO8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   14.81944100
_cell_length_b   5.55251100
_cell_length_c   8.87440800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlCr2FeO8
_chemical_formula_sum   'Tl4 Cr8 Fe4 O32'
_cell_volume   730.23163107
_cell_formula_units_Z   4
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
  Tl  Tl0  1  5.66578350  1.38812775  0.50273521  1
  Tl  Tl1  1  9.15365750  4.16438325  8.37167279  1
  Tl  Tl2  1  1.74393700  4.16438325  4.93993921  1
  Tl  Tl3  1  13.07550400  1.38812775  3.93446879  1
  Cr  Cr4  1  2.37761629  1.38812775  2.27575319  1
  Cr  Cr5  1  12.44182471  4.16438325  6.59865481  1
  Cr  Cr6  1  5.03210421  4.16438325  6.71295719  1
  Cr  Cr7  1  9.78733679  1.38812775  2.16145081  1
  Cr  Cr8  1  0.95000027  1.38812775  7.24563465  1
  Cr  Cr9  1  13.86944073  4.16438325  1.62877335  1
  Cr  Cr10  1  6.45972023  4.16438325  2.80843065  1
  Cr  Cr11  1  8.35972077  1.38812775  6.06597735  1
  Fe  Fe12  1  5.08563203  1.38812775  4.47632239  1
  Fe  Fe13  1  9.73380897  4.16438325  4.39808561  1
  Fe  Fe14  1  2.32408847  4.16438325  0.03911839  1
  Fe  Fe15  1  12.49535253  1.38812775  8.83528961  1
  O  O16  1  0.78811269  1.38812775  2.54778929  1
  O  O17  1  14.03132831  4.16438325  6.32661871  1
  O  O18  1  6.62160781  4.16438325  6.98499329  1
  O  O19  1  8.19783319  1.38812775  1.88941471  1
  O  O20  1  0.54534061  1.38812775  5.66257338  1
  O  O21  1  14.27410039  4.16438325  3.21183462  1
  O  O22  1  6.86437989  4.16438325  1.22536938  1
  O  O23  1  7.95506111  1.38812775  7.64903862  1
  O  O24  1  7.00162273  1.38812775  5.11062070  1
  O  O25  1  7.81781827  4.16438325  3.76378730  1
  O  O26  1  0.40809777  4.16438325  0.67341670  1
  O  O27  1  14.41134323  1.38812775  8.20099130  1
  O  O28  1  5.53602448  5.54583133  3.10440103  1
  O  O29  1  9.28341652  0.00667967  5.77000697  1
  O  O30  1  1.87369602  0.00667967  7.54160503  1
  O  O31  1  9.28341652  2.76957583  5.77000697  1
  O  O32  1  12.94574498  5.54583133  1.33280297  1
  O  O33  1  5.53602448  2.78293517  3.10440103  1
  O  O34  1  12.94574498  2.78293517  1.33280297  1
  O  O35  1  1.87369602  2.76957583  7.54160503  1
  O  O36  1  3.18364569  1.38812775  3.76652949  1
  O  O37  1  11.63579531  4.16438325  5.10787851  1
  O  O38  1  4.22607481  4.16438325  8.20373349  1
  O  O39  1  10.59336619  1.38812775  0.67067451  1
  O  O40  1  2.80240075  0.02427558  1.38998965  1
  O  O41  1  12.01704025  5.52823542  7.48441835  1
  O  O42  1  4.60731975  5.52823542  5.82719365  1
  O  O43  1  12.01704025  2.80053108  7.48441835  1
  O  O44  1  10.21212125  0.02427558  3.04721435  1
  O  O45  1  2.80240075  2.75197992  1.38998965  1
  O  O46  1  10.21212125  2.75197992  3.04721435  1
  O  O47  1  4.60731975  2.80053108  5.82719365  1
[/CIF]
