data_LaCr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.22
_cell_length_b   6.22
_cell_length_c   7.51
_cell_angle_alpha   109.56
_cell_angle_beta   109.56
_cell_angle_gamma   35.14
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaCr
_chemical_formula_sum   'La3 Cr3'
_cell_volume   156.47
_cell_formula_units_Z   3
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  0.68  0.0  0.51  1.0
  La  La4  1  0.0  0.0  0.12  1.0
  La  La5  1  0.22  0.0  0.91  1.0
  Cr  Cr0  1  0.78  0.0  1.0  1.0
  Cr  Cr1  1  0.44  0.0  0.03  1.0
  Cr  Cr2  1  0.0  0.0  0.0  1.0

data_LaCr
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.75
_cell_length_b   6.22
_cell_length_c   7.51
_cell_angle_alpha   109.56
_cell_angle_beta   90.0
_cell_angle_gamma   107.57
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaCr
_chemical_formula_sum   'La3 Cr3'
_cell_volume   156.47
_cell_formula_units_Z   3
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  0.32  0.49  1.0
  La  La1  1  0.0  0.78  0.09  1.0
  La  La2  1  0.0  1.0  0.88  1.0
  Cr  Cr3  1  0.0  0.0  0.0  1.0
  Cr  Cr4  1  0.0  0.22  0.0  1.0
  Cr  Cr5  1  0.0  0.56  0.97  1.0

La La La Cr Cr Cr