data_LaMg2V
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.42
_cell_length_b   6.42
_cell_length_c   4.94
_cell_angle_alpha   112.01
_cell_angle_beta   112.01
_cell_angle_gamma   29.1
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaMg2V
_chemical_formula_sum   'La1 Mg2 V1'
_cell_volume   91.23
_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  0.25  0.0  0.28  1.0
  Mg  Mg1  1  0.46  0.0  0.97  1.0
  Mg  Mg2  1  0.05  0.0  0.58  1.0
  V  V3  1  0.0  0.0  0.0  1.0

data_LaMg2V
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.22
_cell_length_b   4.94
_cell_length_c   6.42
_cell_angle_alpha   112.01
_cell_angle_beta   104.55
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaMg2V
_chemical_formula_sum   'La1 Mg2 V1'
_cell_volume   91.23
_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  0.28  0.25  1.0
  Mg  Mg1  1  0.0  0.58  0.05  1.0
  Mg  Mg2  1  0.0  0.97  0.46  1.0
  V  V3  1  0.0  0.0  0.0  1.0

La Mg Mg V