data_LaBeMo2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.49
_cell_length_b   4.32
_cell_length_c   5.26
_cell_angle_alpha   90.0
_cell_angle_beta   102.29
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaBeMo2
_chemical_formula_sum   'La1 Be1 Mo2'
_cell_volume   77.49
_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  0.18  0.0  0.57  1.0
  Be  Be0  1  0.0  0.0  0.0  1.0
  Mo  Mo2  1  0.71  0.16  0.25  1.0
  Mo  Mo3  1  0.66  0.16  0.88  1.0

data_LaBeMo2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.49
_cell_length_b   4.32
_cell_length_c   5.26
_cell_angle_alpha   90.0
_cell_angle_beta   102.29
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaBeMo2
_chemical_formula_sum   'La1 Be1 Mo2'
_cell_volume   77.49
_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  0.18  0.0  0.57  1.0
  Be  Be1  1  0.0  0.0  0.0  1.0
  Mo  Mo2  1  0.66  0.16  0.88  1.0
  Mo  Mo3  1  0.71  0.16  0.25  1.0

La Be Mo Mo