# generated using pymatgen
data_Tb12Co2I17
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.67118011
_cell_length_b   11.61863577
_cell_length_c   11.57315514
_cell_angle_alpha   93.27674689
_cell_angle_beta   104.65446011
_cell_angle_gamma   114.46132006
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tb12Co2I17
_chemical_formula_sum   'Tb12 Co2 I17'
_cell_volume   1125.67254215
_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
  Tb  Tb0  1  0.05171261  0.50290904  0.32141050  1.0
  Tb  Tb1  1  0.99263095  0.80871173  0.58689896  1.0
  Tb  Tb2  1  0.65168942  0.24143194  0.28137112  1.0
  Tb  Tb3  1  0.00736905  0.19128827  0.41310104  1.0
  Tb  Tb4  1  0.21452401  0.66849600  0.98338093  1.0
  Tb  Tb5  1  0.25667311  0.97663473  0.89037006  1.0
  Tb  Tb6  1  0.34831058  0.75856806  0.71862888  1.0
  Tb  Tb7  1  0.94828739  0.49709096  0.67858950  1.0
  Tb  Tb8  1  0.74332689  0.02336527  0.10962994  1.0
  Tb  Tb9  1  0.14428261  0.28746767  0.15195210  1.0
  Tb  Tb10  1  0.78547599  0.33150400  0.01661907  1.0
  Tb  Tb11  1  0.85571739  0.71253233  0.84804790  1.0
  Co  Co12  1  0.10334137  0.73725813  0.78456338  1.0
  Co  Co13  1  0.89665863  0.26274187  0.21543662  1.0
  I  I14  1  0.77731780  0.52945830  0.41638034  1.0
  I  I15  1  0.63970406  0.41789471  0.76023075  1.0
  I  I16  1  0.84284466  0.89443091  0.32758932  1.0
  I  I17  1  0.33048770  0.21279339  0.36933772  1.0
  I  I18  1  0.15715534  0.10556909  0.67241068  1.0
  I  I19  1  0.58805514  0.05547636  0.83821053  1.0
  I  I20  1  0.75591616  0.18646135  0.54197957  1.0
  I  I21  1  0.55335360  0.70984170  0.95655305  1.0
  I  I22  1  0.36029594  0.58210529  0.23976925  1.0
  I  I23  1  0.22268220  0.47054170  0.58361966  1.0
  I  I24  1  0.05935148  0.36278979  0.89126737  1.0
  I  I25  1  0.44664640  0.29015830  0.04344695  1.0
  I  I26  1  0.00000000  0.00000000  0.00000000  1.0
  I  I27  1  0.24408384  0.81353865  0.45802043  1.0
  I  I28  1  0.41194486  0.94452364  0.16178947  1.0
  I  I29  1  0.66951230  0.78720661  0.63066228  1.0
  I  I30  1  0.94064852  0.63721021  0.10873263  1.0