# generated using pymatgen
data_Co(NiS2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.18138259
_cell_length_b   3.36792286
_cell_length_c   5.91782182
_cell_angle_alpha   90.00000000
_cell_angle_beta   92.57958590
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Co(NiS2)2
_chemical_formula_sum   'Co1 Ni2 S4'
_cell_volume   103.16428554
_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
  Co  Co0  1  0.50000000  0.00000000  -0.00000000  1
  Ni  Ni1  1  0.50000000  0.50000000  0.50000000  1
  Ni  Ni2  1  0.00000000  0.00000000  0.00000000  1
  S  S3  1  0.74562400  0.50000000  0.16370500  1
  S  S4  1  0.71541000  0.00000000  0.67895100  1
  S  S5  1  0.28459000  0.00000000  0.32104900  1
  S  S6  1  0.25437600  0.50000000  0.83629500  1
