# generated using pymatgen
data_MgTi4(CuS4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.28080131
_cell_length_b   7.03912073
_cell_length_c   7.04169314
_cell_angle_alpha   60.00535775
_cell_angle_beta   61.10013597
_cell_angle_gamma   61.08608760
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgTi4(CuS4)2
_chemical_formula_sum   'Mg1 Ti4 Cu2 S8'
_cell_volume   259.33383681
_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  0.00000000  0.00000000  1.0
  Ti  Ti1  1  0.50000000  0.99999900  0.50000000  1.0
  Ti  Ti2  1  0.99999900  0.50000000  0.50000000  1.0
  Ti  Ti3  1  0.50000000  0.50000100  0.99999900  1.0
  Ti  Ti4  1  0.50000000  0.50000000  0.50000000  1.0
  Cu  Cu5  1  0.91953600  0.86002700  0.86029300  1.0
  Cu  Cu6  1  0.08046300  0.13997300  0.13970700  1.0
  S  S7  1  0.74943500  0.74545100  0.74538500  1.0
  S  S8  1  0.25059000  0.25456600  0.74025900  1.0
  S  S9  1  0.25058700  0.74028800  0.25458400  1.0
  S  S10  1  0.72057600  0.25982000  0.25983800  1.0
  S  S11  1  0.74941500  0.25970700  0.74541700  1.0
  S  S12  1  0.27942000  0.74018100  0.74016300  1.0
  S  S13  1  0.25056700  0.25455000  0.25461800  1.0
  S  S14  1  0.74941200  0.74543600  0.25973700  1.0