data_[Ca1La2Tm1As4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ca  1.0000  1.8000  1.1400
  La  1.1000  1.9500  1.1720
  Tm  1.2500  1.7500  1.0950
  As  2.1800  1.1500  0.6600
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [7.3001]
_cell_length_b [4.2875]
_cell_length_c [7.4886]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.9956]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [CaLa2TmAs4]
_chemical_formula_sum '[Ca1 La2 Tm1 As4]'
_cell_volume [220.2559]
_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
[
  Ca  Ca0  1  0.5000  0.5000  0.0000  1.0
  La  La1  1  0.0000  0.0000  0.0000  1.0
  La  La2  1  0.0000  0.5000  0.5000  1.0
  Tm  Tm3  1  0.5000  0.0000  0.5000  1.0
  As  As4  2  0.2583  0.0000  0.7450  1.0
  As  As5  2  0.2632  0.5000  0.2608  1.0
]