data_Li2MgCo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.39
_cell_length_b   5.39
_cell_length_c   2.69
_cell_angle_alpha   102.51
_cell_angle_beta   102.51
_cell_angle_gamma   121.34
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2MgCo
_chemical_formula_sum   'Li2 Mg1 Co1'
_cell_volume   60.0
_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  0.72  0.65  0.21  1.0
  Li  Li2  1  0.72  0.35  0.21  1.0
  Mg  Mg3  1  0.0  0.0  0.0  1.0
  Co  Co0  1  0.64  0.0  0.0  1.0

data_Li2MgCo
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.69
_cell_length_b   4.75
_cell_length_c   5.39
_cell_angle_alpha   114.94
_cell_angle_beta   102.51
_cell_angle_gamma   94.33
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2MgCo
_chemical_formula_sum   'Li2 Mg1 Co1'
_cell_volume   60.0
_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  0.56  0.35  0.07  1.0
  Li  Li1  1  0.86  0.65  0.37  1.0
  Mg  Mg2  1  0.0  0.0  0.0  1.0
  Co  Co3  1  0.0  0.0  0.64  1.0

Li Li Mg Co