# generated using pymatgen
data_MgZn2(NiS2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.01863106
_cell_length_b   8.01838856
_cell_length_c   6.62965505
_cell_angle_alpha   114.12850819
_cell_angle_beta   114.82164354
_cell_angle_gamma   108.37687847
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgZn2(NiS2)4
_chemical_formula_sum   'Mg1 Zn2 Ni4 S8'
_cell_volume   285.65123324
_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  0.86208194  0.11206567  0.75042887  1.0
  Zn  Zn1  1  0.37989426  0.62983578  0.75096461  1.0
  Zn  Zn2  1  0.62157398  0.37160504  0.25029025  1.0
  Ni  Ni3  1  0.04170393  0.95996888  0.49534412  1.0
  Ni  Ni4  1  0.96405262  0.54577847  0.00435842  1.0
  Ni  Ni5  1  0.45249400  0.03987673  0.49520631  1.0
  Ni  Ni6  1  0.04494044  0.95757730  0.00455076  1.0
  S  S7  1  0.80246973  0.75527820  0.52700998  1.0
  S  S8  1  0.72774472  0.27488061  0.97275204  1.0
  S  S9  1  0.23836823  0.20313795  0.96960387  1.0
  S  S10  1  0.24206736  0.20272590  0.47102787  1.0
  S  S11  1  0.23012322  0.77368555  0.47508017  1.0
  S  S12  1  0.23122171  0.77055704  0.02875552  1.0
  S  S13  1  0.73296430  0.26814150  0.53007573  1.0
  S  S14  1  0.79866956  0.75525538  0.02455148  1.0