data_[Th2Mn1Co3P4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Th  1.3000  1.8000  1.0800
  Mn  1.5500  1.4000  0.6483
  Co  1.8800  1.3500  0.7683
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [P-4m2]
_cell_length_a [4.0223]
_cell_length_b [4.0223]
_cell_length_c [9.1557]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [115]
_chemical_formula_structural [Th2MnCo3P4]
_chemical_formula_sum '[Th2 Mn1 Co3 P4]'
_cell_volume [148.1308]
_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
[
  Th  Th0  2  0.0000  0.5000  0.7531  1
  Mn  Mn1  1  0.5000  0.5000  0.5000  1
  Co  Co2  2  0.0000  0.5000  0.1095  1
  Co  Co3  1  0.0000  0.0000  0.5000  1
  P  P4  2  0.0000  0.5000  0.3714  1
  P  P5  1  0.0000  0.0000  0.0000  1
  P  P6  1  0.5000  0.5000  0.0000  1
]