data_KCo2Mo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.6
_cell_length_b   4.6
_cell_length_c   6.64
_cell_angle_alpha   97.0
_cell_angle_beta   97.0
_cell_angle_gamma   34.58
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KCo2Mo
_chemical_formula_sum   'K1 Co2 Mo1'
_cell_volume   78.96
_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  K2  1  0.06  0.0  0.44  1.0
  Co  Co0  1  0.64  0.0  0.13  1.0
  Co  Co1  1  0.81  0.0  0.57  1.0
  Mo  Mo3  1  0.17  0.0  0.73  1.0

data_KCo2Mo
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.73
_cell_length_b   4.6
_cell_length_c   6.64
_cell_angle_alpha   97.0
_cell_angle_beta   90.0
_cell_angle_gamma   107.29
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KCo2Mo
_chemical_formula_sum   'K1 Co2 Mo1'
_cell_volume   78.96
_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  0.94  0.56  1.0
  Co  Co1  1  0.0  0.19  0.43  1.0
  Co  Co2  1  0.0  0.36  0.87  1.0
  Mo  Mo3  1  0.0  0.83  0.27  1.0

K Co Co Mo