data_[Tm12Te8P4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Te  2.1000  1.4000  1.2933
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.2024]
_cell_length_b [12.4451]
_cell_length_c [7.3617]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.0275]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tm3Te2P]
_chemical_formula_sum '[Tm12 Te8 P4]'
_cell_volume [623.8091]
_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
[
  Tm  Tm0  8  0.2463  0.3200  0.7831  1
  Tm  Tm1  4  0.2095  0.5000  0.2106  1
  Te  Te2  4  0.0000  0.1579  0.5000  1
  Te  Te3  2  0.0000  0.0000  0.0000  1
  Te  Te4  2  0.0000  0.5000  0.5000  1
  P  P5  4  0.0000  0.3317  0.0000  1
]