[CIF]
data_Ca2LaSe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.21591992
_cell_length_b   6.21591992
_cell_length_c   6.80332064
_cell_angle_alpha   115.74188274
_cell_angle_beta   115.74188274
_cell_angle_gamma   35.82423163
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ca2LaSe
_chemical_formula_sum   'Ca2 La1 Se1'
_cell_volume   136.89273177
_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  7.93288271  -0.00000000  5.95660483  1
  Ca  Ca1  1  7.89875018  0.00000000  1.66008448  1
  La  La2  1  4.64489801  -0.00000000  3.73877834  1
  Se  Se3  1  1.33332419  0.00000000  3.77772561  1
[/CIF]
