# generated using pymatgen
data_MgMnNiS4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.07500570
_cell_length_b   7.10127683
_cell_length_c   7.09253558
_cell_angle_alpha   59.17760709
_cell_angle_beta   60.05541355
_cell_angle_gamma   60.09883049
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgMnNiS4
_chemical_formula_sum   'Mg2 Mn2 Ni2 S8'
_cell_volume   250.65513595
_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
  Mg  Mg0  1  0.87175300  0.87815400  0.87837600  1.0
  Mg  Mg1  1  0.12826400  0.12183900  0.12162200  1.0
  Mn  Mn2  1  0.49997200  0.50002300  0.00000400  1.0
  Mn  Mn3  1  0.49997600  0.00001000  0.50002800  1.0
  Ni  Ni4  1  0.50001400  0.50000700  0.49999200  1.0
  Ni  Ni5  1  0.99999500  0.49998800  0.50000000  1.0
  S  S6  1  0.73311600  0.73709100  0.73723400  1.0
  S  S7  1  0.26798600  0.26375000  0.70035600  1.0
  S  S8  1  0.26818100  0.70006000  0.26363400  1.0
  S  S9  1  0.70741900  0.26290500  0.26280600  1.0
  S  S10  1  0.73183100  0.29993600  0.73633600  1.0
  S  S11  1  0.29259400  0.73704700  0.73720400  1.0
  S  S12  1  0.26688100  0.26289700  0.26277400  1.0
  S  S13  1  0.73202200  0.73628900  0.29963500  1.0