# generated using pymatgen
data_Mg2TiCo3S8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.08311032
_cell_length_b   7.00041438
_cell_length_c   7.08192307
_cell_angle_alpha   59.59968331
_cell_angle_beta   59.99309939
_cell_angle_gamma   59.60583550
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg2TiCo3S8
_chemical_formula_sum   'Mg2 Ti1 Co3 S8'
_cell_volume   246.79007388
_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  0.87530700  0.87412600  0.87527100  1.0
  Mg  Mg1  1  0.12469700  0.12587100  0.12473100  1.0
  Ti  Ti2  1  0.49999200  0.99999600  0.50000800  1.0
  Co  Co3  1  0.50000100  0.50000900  0.49999100  1.0
  Co  Co4  1  0.50000000  0.49999800  0.99999900  1.0
  Co  Co5  1  0.00000200  0.49999700  0.50000400  1.0
  S  S6  1  0.74376600  0.71728900  0.74372300  1.0
  S  S7  1  0.25622200  0.28269400  0.70479900  1.0
  S  S8  1  0.26889400  0.69317100  0.26896800  1.0
  S  S9  1  0.70481900  0.28267600  0.25623700  1.0
  S  S10  1  0.73110100  0.30683000  0.73102300  1.0
  S  S11  1  0.29517700  0.71732100  0.74376500  1.0
  S  S12  1  0.25623400  0.28270600  0.25628300  1.0
  S  S13  1  0.74379200  0.71731200  0.29519900  1.0