data_LaZn2Co
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.63
_cell_length_b   3.84
_cell_length_c   5.96
_cell_angle_alpha   90.0
_cell_angle_beta   104.55
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaZn2Co
_chemical_formula_sum   'La1 Zn2 Co1'
_cell_volume   80.54
_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  0.9  0.92  0.89  1.0
  Zn  Zn2  1  0.88  0.0  0.85  1.0
  Zn  Zn3  1  0.73  0.92  0.22  1.0
  Co  Co0  1  0.7  0.0  0.7  1.0

data_LaZn2Co
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.63
_cell_length_b   3.84
_cell_length_c   5.96
_cell_angle_alpha   90.0
_cell_angle_beta   104.55
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaZn2Co
_chemical_formula_sum   'La1 Zn2 Co1'
_cell_volume   80.54
_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  0.9  0.92  0.89  1.0
  Zn  Zn1  1  0.73  0.92  0.22  1.0
  Zn  Zn2  1  0.88  0.0  0.85  1.0
  Co  Co3  1  0.7  0.0  0.7  1.0

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