data_La2BeV
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.93
_cell_length_b   5.93
_cell_length_c   5.93
_cell_angle_alpha   144.16
_cell_angle_beta   130.83
_cell_angle_gamma   62.32
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2BeV
_chemical_formula_sum   'La2 Be1 V1'
_cell_volume   91.57
_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  0.0  0.47  0.77  1.0
  La  La2  1  0.0  0.0  0.74  1.0
  Be  Be0  1  0.0  0.0  0.13  1.0
  V  V3  1  0.0  0.47  0.59  1.0

data_La2BeV
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.65
_cell_length_b   4.94
_cell_length_c   5.93
_cell_angle_alpha   114.58
_cell_angle_beta   107.92
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2BeV
_chemical_formula_sum   'La2 Be1 V1'
_cell_volume   91.57
_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  0.7  0.7  1.0
  La  La1  1  0.26  0.26  0.26  1.0
  Be  Be2  1  0.87  0.87  0.87  1.0
  V  V3  1  0.41  0.88  0.88  1.0

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