# generated using pymatgen
data_Mg2Mn3NiS8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.19950596
_cell_length_b   7.20064392
_cell_length_c   7.20439155
_cell_angle_alpha   59.87777306
_cell_angle_beta   59.87213236
_cell_angle_gamma   59.87180270
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg2Mn3NiS8
_chemical_formula_sum   'Mg2 Mn3 Ni1 S8'
_cell_volume   263.33704213
_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  0.87678800  0.87668400  0.87681300  1.0
  Mg  Mg1  1  0.12322800  0.12332200  0.12319400  1.0
  Mn  Mn2  1  0.49997400  0.50002300  0.99999800  1.0
  Mn  Mn3  1  0.99994500  0.50002300  0.49984100  1.0
  Mn  Mn4  1  0.50007000  0.99993700  0.50016000  1.0
  Ni  Ni5  1  0.49996500  0.50002500  0.49998800  1.0
  S  S6  1  0.73880500  0.73877100  0.73886100  1.0
  S  S7  1  0.26526900  0.26570400  0.70682300  1.0
  S  S8  1  0.26536500  0.70685400  0.26562800  1.0
  S  S9  1  0.70678400  0.26563700  0.26550000  1.0
  S  S10  1  0.73461600  0.29314500  0.73437200  1.0
  S  S11  1  0.29323800  0.73435500  0.73450200  1.0
  S  S12  1  0.26125400  0.26117700  0.26117200  1.0
  S  S13  1  0.73470500  0.73433800  0.29315100  1.0