data_K2LiMn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.07
_cell_length_b   7.07
_cell_length_c   6.6
_cell_angle_alpha   108.63
_cell_angle_beta   108.63
_cell_angle_gamma   29.29
_symmetry_Int_Tables_number   1
_chemical_formula_structural   K2LiMn
_chemical_formula_sum   'K2 Li1 Mn1'
_cell_volume   152.51
_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
  K  K0  1  0.25  0.0  0.35  1.0
  K  K1  1  0.62  0.0  0.39  1.0
  Li  Li2  1  0.1  0.0  0.04  1.0
  Mn  Mn3  1  0.3  0.0  0.56  1.0

data_K2LiMn
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.58
_cell_length_b   6.6
_cell_length_c   7.07
_cell_angle_alpha   108.63
_cell_angle_beta   104.64
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   K2LiMn
_chemical_formula_sum   'K2 Li1 Mn1'
_cell_volume   152.51
_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
  K  K0  1  0.0  0.35  0.25  1.0
  K  K1  1  0.0  0.39  0.62  1.0
  Li  Li2  1  0.0  0.04  0.1  1.0
  Mn  Mn3  1  0.0  0.56  0.3  1.0

K K Li Mn
K K Li Mn 0 3 o o o 0 1 o o o 0 2 o o o 1 3 o o o 