data_[Pr8Tm4Mn4Te20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Tm  1.2500  1.7500  1.0950
  Mn  1.5500  1.4000  0.6483
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [4.3198]
_cell_length_b [18.7319]
_cell_length_c [13.3867]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Pr2TmMnTe5]
_chemical_formula_sum '[Pr8 Tm4 Mn4 Te20]'
_cell_volume [1083.2172]
_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
[
  Pr  Pr0  4  0.0000  0.1153  0.3459  1.0
  Pr  Pr1  4  0.0000  0.1236  0.6968  1.0
  Tm  Tm2  4  0.0000  0.1776  0.0217  1.0
  Mn  Mn3  4  0.0000  0.4398  0.4263  1.0
  Te  Te4  4  0.0000  0.0149  0.0229  1.0
  Te  Te5  4  0.0000  0.3031  0.3571  1.0
  Te  Te6  4  0.0000  0.3051  0.6837  1.0
  Te  Te7  4  0.0000  0.3407  0.0189  1.0
  Te  Te8  4  0.0000  0.4975  0.7507  1.0
]