# generated using pymatgen
data_Mg(CoS2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.70305700
_cell_length_b   6.70305700
_cell_length_c   6.70305740
_cell_angle_alpha   60.73372682
_cell_angle_beta   60.73372682
_cell_angle_gamma   60.73372834
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg(CoS2)4
_chemical_formula_sum   'Mg1 Co4 S8'
_cell_volume   216.48875915
_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  0.00000000  0.00000000  0.00000000  1.0
  Co  Co1  1  0.50000000  0.50000000  0.50000000  1.0
  Co  Co2  1  0.50000000  0.50000000  0.00000000  1.0
  Co  Co3  1  0.50000000  0.00000000  0.50000000  1.0
  Co  Co4  1  0.00000000  0.50000000  0.50000000  1.0
  S  S5  1  0.73630800  0.29281100  0.73630800  1.0
  S  S6  1  0.73630800  0.73630800  0.29281100  1.0
  S  S7  1  0.29281100  0.73630800  0.73630800  1.0
  S  S8  1  0.73637100  0.73637100  0.73637100  1.0
  S  S9  1  0.26362900  0.26362900  0.26362900  1.0
  S  S10  1  0.26369200  0.26369200  0.70718900  1.0
  S  S11  1  0.70718900  0.26369200  0.26369200  1.0
  S  S12  1  0.26369200  0.70718900  0.26369200  1.0