data_LaCrSe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.33
_cell_length_b   4.33
_cell_length_c   6.7
_cell_angle_alpha   110.14
_cell_angle_beta   110.14
_cell_angle_gamma   55.92
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaCrSe2
_chemical_formula_sum   'La1 Cr1 Se2'
_cell_volume   96.07
_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
  La  La1  1  0.52  0.0  0.09  1.0
  Cr  Cr0  1  0.0  0.0  0.0  1.0
  Se  Se2  1  0.01  0.0  0.34  1.0
  Se  Se3  1  0.04  0.0  0.84  1.0

data_LaCrSe2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.06
_cell_length_b   4.33
_cell_length_c   6.61
_cell_angle_alpha   72.16
_cell_angle_beta   72.1
_cell_angle_gamma   62.04
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaCrSe2
_chemical_formula_sum   'La1 Cr1 Se2'
_cell_volume   96.07
_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
  La  La0  1  0.0  0.43  0.09  1.0
  Cr  Cr1  1  0.0  0.0  0.0  1.0
  Se  Se2  1  0.0  0.2  0.84  1.0
  Se  Se3  1  0.0  0.67  0.34  1.0

La Cr Se Se