data_Zn(CoS2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.82
_cell_length_b   6.82
_cell_length_c   6.82
_cell_angle_alpha   119.57
_cell_angle_beta   119.08
_cell_angle_gamma   91.17
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zn(CoS2)2
_chemical_formula_sum   'Zn2 Co4 S8'
_cell_volume   226.56
_cell_formula_units_Z   2
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
  Zn  Zn0  1  0.43  0.0  0.0  1.0
  Zn  Zn1  1  0.0  0.0  0.77  1.0
  Co  Co2  1  0.28  0.73  0.39  1.0
  Co  Co3  1  0.0  0.0  0.0  1.0
  Co  Co4  1  0.72  0.73  0.39  1.0
  Co  Co5  1  0.0  0.46  0.0  1.0
  S  S6  1  0.0  0.21  0.32  1.0
  S  S7  1  0.91  0.27  0.94  1.0
  S  S8  1  0.0  0.25  0.32  1.0
  S  S9  1  0.91  0.73  0.61  1.0
  S  S10  1  0.43  0.21  0.45  1.0
  S  S11  1  0.52  0.19  0.83  1.0
  S  S12  1  0.52  0.73  0.17  1.0
  S  S13  1  0.43  0.25  0.45  1.0

data_Zn(CoS2)2
_symmetry_space_group_name_H-M   P1
_cell_length_a   6.82
_cell_length_b   6.82
_cell_length_c   6.82
_cell_angle_alpha   91.17
_cell_angle_beta   119.08
_cell_angle_gamma   119.57
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zn(CoS2)2
_chemical_formula_sum   'Zn2 Co4 S8'
_cell_volume   226.56
_cell_formula_units_Z   2
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
  Zn  Zn0  1  0.0  0.0  0.57  1.0
  Zn  Zn1  1  0.23  0.0  0.0  1.0
  Co  Co2  1  0.0  0.0  0.0  1.0
  Co  Co3  1  0.0  0.54  -0.0  1.0
  Co  Co4  1  0.61  0.27  0.28  1.0
  Co  Co5  1  0.61  0.27  0.72  1.0
  S  S6  1  0.06  0.73  0.09  1.0
  S  S7  1  0.17  0.81  0.48  1.0
  S  S8  1  0.39  0.27  0.09  1.0
  S  S9  1  0.55  0.75  0.57  1.0
  S  S10  1  0.55  0.79  0.57  1.0
  S  S11  1  0.68  0.75  -0.0  1.0
  S  S12  1  0.68  0.79  -0.0  1.0
  S  S13  1  0.83  0.27  0.48  1.0

Zn Zn Co Co Co Co S S S S S S S S