# generated using pymatgen
data_MgCo2(NiS2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.91547191
_cell_length_b   6.91547309
_cell_length_c   6.87795814
_cell_angle_alpha   57.69637739
_cell_angle_beta   57.69637528
_cell_angle_gamma   57.61504915
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgCo2(NiS2)4
_chemical_formula_sum   'Mg1 Co2 Ni4 S8'
_cell_volume   220.13111662
_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
  Mg  Mg0  1  0.00000000  0.00000000  0.00000000  1.0
  Co  Co1  1  0.50000000  0.50000000  0.00000000  1.0
  Co  Co2  1  0.50000000  0.50000000  0.50000000  1.0
  Ni  Ni3  1  0.14013300  0.14013300  0.13947500  1.0
  Ni  Ni4  1  0.00000000  0.50000000  0.50000000  1.0
  Ni  Ni5  1  0.50000000  0.00000000  0.50000000  1.0
  Ni  Ni6  1  0.85986700  0.85986700  0.86052500  1.0
  S  S7  1  0.26723100  0.26723100  0.26256500  1.0
  S  S8  1  0.26437900  0.26437900  0.72759000  1.0
  S  S9  1  0.26742300  0.72199600  0.26133400  1.0
  S  S10  1  0.72199600  0.26742300  0.26133400  1.0
  S  S11  1  0.27800400  0.73257700  0.73866600  1.0
  S  S12  1  0.73257700  0.27800400  0.73866600  1.0
  S  S13  1  0.73562100  0.73562100  0.27241100  1.0
  S  S14  1  0.73276900  0.73276900  0.73743500  1.0