# generated using pymatgen
data_MgZn2(NiS2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.81660160
_cell_length_b   6.62389276
_cell_length_c   7.35924975
_cell_angle_alpha   116.66324303
_cell_angle_beta   117.58937862
_cell_angle_gamma   89.99999946
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgZn2(NiS2)4
_chemical_formula_sum   'Mg1 Zn2 Ni4 S8'
_cell_volume   253.96379759
_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  0.86665200  0.61706300  0.73330400  1.0
  Zn  Zn1  1  0.40856300  0.65831200  0.81712500  1.0
  Zn  Zn2  1  0.58936600  0.34132200  0.17873200  1.0
  Ni  Ni3  1  0.01162300  0.01160700  0.52221800  1.0
  Ni  Ni4  1  0.03814900  0.52667700  0.07629700  1.0
  Ni  Ni5  1  0.51059400  0.01160700  0.52221800  1.0
  Ni  Ni6  1  0.03933000  0.04907500  0.07866000  1.0
  S  S7  1  0.73159600  0.75465100  0.46319200  1.0
  S  S8  1  0.77585500  0.23087800  0.96299200  1.0
  S  S9  1  0.18713700  0.23087800  0.96299200  1.0
  S  S10  1  0.26575300  0.24610800  0.53150500  1.0
  S  S11  1  0.26652100  0.78668800  0.53304100  1.0
  S  S12  1  0.26621800  0.79233400  0.08716100  1.0
  S  S13  1  0.73095900  0.20972200  0.46191900  1.0
  S  S14  1  0.82094200  0.79233400  0.08716100  1.0