# generated using pymatgen
data_Mg2MnNi3S8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.01530486
_cell_length_b   7.02505058
_cell_length_c   7.01745850
_cell_angle_alpha   60.01584927
_cell_angle_beta   60.01945398
_cell_angle_gamma   60.12637430
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg2MnNi3S8
_chemical_formula_sum   'Mg2 Mn1 Ni3 S8'
_cell_volume   244.84428276
_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  0.87386800  0.87834500  0.87386800  1.0
  Mg  Mg1  1  0.12613400  0.12161600  0.12612800  1.0
  Mn  Mn2  1  0.50003900  0.00003300  0.49996900  1.0
  Ni  Ni3  1  0.50001800  0.49996000  0.50002400  1.0
  Ni  Ni4  1  0.49997000  0.50004800  0.00000200  1.0
  Ni  Ni5  1  0.99999500  0.50000000  0.50001500  1.0
  S  S6  1  0.73223300  0.73764400  0.73150600  1.0
  S  S7  1  0.26803300  0.26142300  0.70169700  1.0
  S  S8  1  0.26757700  0.69643100  0.26852400  1.0
  S  S9  1  0.70155900  0.26278900  0.26810400  1.0
  S  S10  1  0.73242800  0.30352600  0.73152900  1.0
  S  S11  1  0.29844000  0.73722900  0.73188500  1.0
  S  S12  1  0.26769600  0.26243500  0.26845300  1.0
  S  S13  1  0.73201400  0.73851900  0.29829700  1.0