data_KSr2Co
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.35
_cell_length_b   7.35
_cell_length_c   7.35
_cell_angle_alpha   144.38
_cell_angle_beta   131.1
_cell_angle_gamma   61.95
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KSr2Co
_chemical_formula_sum   'K1 Sr2 Co1'
_cell_volume   172.48
_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  K1  1  0.0  0.0  0.41  1.0
  Sr  Sr2  1  0.0  0.04  0.3  1.0
  Sr  Sr3  1  0.0  0.0  0.22  1.0
  Co  Co0  1  0.25  0.0  0.28  1.0

data_KSr2Co
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.5
_cell_length_b   6.09
_cell_length_c   7.35
_cell_angle_alpha   114.45
_cell_angle_beta   107.81
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KSr2Co
_chemical_formula_sum   'K1 Sr2 Co1'
_cell_volume   172.48
_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  0.41  0.41  1.0
  Sr  Sr1  1  0.0  0.22  0.22  1.0
  Sr  Sr2  1  0.96  0.25  0.25  1.0
  Co  Co3  1  0.0  0.28  0.04  1.0

K Sr Sr Co
K Sr Sr Co 0 1 o o o 1 2 o o o 1 3 o o o 2 3 o o o 