# generated using pymatgen
data_Mg(CoS2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.05673081
_cell_length_b   7.05673081
_cell_length_c   7.05673134
_cell_angle_alpha   56.43442730
_cell_angle_beta   56.43442730
_cell_angle_gamma   56.43443042
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg(CoS2)4
_chemical_formula_sum   'Mg1 Co4 S8'
_cell_volume   227.99789336
_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  0.50000000  0.50000000  0.50000000  1.0
  Co  Co1  1  0.00000000  0.50000000  0.50000000  1.0
  Co  Co2  1  0.50000000  0.00000000  0.50000000  1.0
  Co  Co3  1  0.50000000  0.50000000  0.00000000  1.0
  Co  Co4  1  0.00000000  0.00000000  0.00000000  1.0
  S  S5  1  0.27076800  0.76429600  0.76429600  1.0
  S  S6  1  0.23570400  0.23570400  0.72923200  1.0
  S  S7  1  0.72923200  0.23570400  0.23570400  1.0
  S  S8  1  0.23570400  0.72923200  0.23570400  1.0
  S  S9  1  0.26629600  0.26629600  0.26629600  1.0
  S  S10  1  0.73370400  0.73370400  0.73370400  1.0
  S  S11  1  0.76429600  0.27076800  0.76429600  1.0
  S  S12  1  0.76429600  0.76429600  0.27076800  1.0