data_LiScCr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.29
_cell_length_b   5.29
_cell_length_c   5.29
_cell_angle_alpha   149.06
_cell_angle_beta   140.44
_cell_angle_gamma   51.05
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiScCr
_chemical_formula_sum   'Li1 Sc1 Cr1'
_cell_volume   48.36
_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
  Li  Li1  1  0.0  0.0  0.21  1.0
  Sc  Sc2  1  0.0  0.0  0.27  1.0
  Cr  Cr0  1  0.0  0.0  0.08  1.0

data_LiScCr
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.82
_cell_length_b   3.58
_cell_length_c   5.29
_cell_angle_alpha   109.78
_cell_angle_beta   105.47
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiScCr
_chemical_formula_sum   'Li1 Sc1 Cr1'
_cell_volume   48.36
_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
  Li  Li0  1  0.0  0.21  0.21  1.0
  Sc  Sc1  1  0.0  0.27  0.27  1.0
  Cr  Cr2  1  0.0  0.08  0.08  1.0

Li Sc Cr