data_LaCr2Co
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.98
_cell_length_b   2.96
_cell_length_c   7.19
_cell_angle_alpha   90.0
_cell_angle_beta   94.41
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaCr2Co
_chemical_formula_sum   'La1 Cr2 Co1'
_cell_volume   63.33
_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  La3  1  0.76  0.48  0.55  1.0
  Cr  Cr1  1  0.29  0.48  0.14  1.0
  Cr  Cr2  1  0.13  0.0  0.92  1.0
  Co  Co0  1  0.4  0.0  0.31  1.0

data_LaCr2Co
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.96
_cell_length_b   2.98
_cell_length_c   7.19
_cell_angle_alpha   94.41
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaCr2Co
_chemical_formula_sum   'La1 Cr2 Co1'
_cell_volume   63.33
_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  0.52  0.24  0.45  1.0
  Cr  Cr1  1  0.0  0.87  0.08  1.0
  Cr  Cr2  1  0.52  0.71  0.86  1.0
  Co  Co3  1  0.0  0.6  0.69  1.0

La Cr Cr Co
La Cr Cr Co 0 3 o o o 0 3 o + o 0 3 + o o 0 3 + + o 0 1 o o o 0 0 + o o 0 0 o + o 0 2 + o o 0 2 + + o 1 2 o o - 1 2 o + - 1 3 o o o 1 3 o + o 