# generated using pymatgen
data_MgTi4(CuS4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.15371047
_cell_length_b   7.38654608
_cell_length_c   7.38672097
_cell_angle_alpha   57.72241052
_cell_angle_beta   61.07525133
_cell_angle_gamma   61.07446256
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgTi4(CuS4)2
_chemical_formula_sum   'Mg1 Ti4 Cu2 S8'
_cell_volume   275.11705083
_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  0.90913100  0.34039300  0.34013600  1.0
  Ti  Ti1  1  0.51019000  0.96792200  0.51150300  1.0
  Ti  Ti2  1  0.97902900  0.54154200  0.54153900  1.0
  Ti  Ti3  1  0.51024800  0.51143000  0.96788700  1.0
  Ti  Ti4  1  0.43810700  0.54170000  0.54171000  1.0
  Cu  Cu5  1  0.85483300  0.89523400  0.89556100  1.0
  Cu  Cu6  1  0.15542000  0.09444900  0.09432500  1.0
  S  S7  1  0.74411900  0.75918100  0.75924200  1.0
  S  S8  1  0.26798200  0.24785000  0.71664700  1.0
  S  S9  1  0.26796000  0.71673300  0.24780300  1.0
  S  S10  1  0.74535100  0.22686100  0.22682100  1.0
  S  S11  1  0.73910700  0.28186600  0.74007200  1.0
  S  S12  1  0.23734400  0.75930200  0.75935500  1.0
  S  S13  1  0.30032600  0.22727300  0.22723100  1.0
  S  S14  1  0.73900200  0.74011500  0.28202100  1.0