data_LaBeFe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.79
_cell_length_b   3.67
_cell_length_c   5.73
_cell_angle_alpha   90.0
_cell_angle_beta   93.31
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaBeFe2
_chemical_formula_sum   'La1 Be1 Fe2'
_cell_volume   58.61
_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  La3  1  0.23  0.0  0.86  1.0
  Be  Be0  1  0.0  0.0  0.0  1.0
  Fe  Fe1  1  0.0  0.83  0.94  1.0
  Fe  Fe2  1  0.46  0.83  0.77  1.0

data_LaBeFe2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.79
_cell_length_b   3.67
_cell_length_c   5.73
_cell_angle_alpha   90.0
_cell_angle_beta   93.31
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaBeFe2
_chemical_formula_sum   'La1 Be1 Fe2'
_cell_volume   58.61
_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  0.23  0.0  0.86  1.0
  Be  Be1  1  0.0  0.0  0.0  1.0
  Fe  Fe2  1  0.0  0.83  0.94  1.0
  Fe  Fe3  1  0.46  0.83  0.77  1.0

La Be Fe Fe
La Be Fe Fe 0 2 o - o 0 1 o o + 0 3 o - o 1 2 o - - 