# generated using pymatgen
data_MnCr8Cu3S16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.12553445
_cell_length_b   12.12553445
_cell_length_c   12.12553462
_cell_angle_alpha   33.67033915
_cell_angle_beta   33.67033915
_cell_angle_gamma   33.67034274
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnCr8Cu3S16
_chemical_formula_sum   'Mn1 Cr8 Cu3 S16'
_cell_volume   488.19613870
_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
  Mn  Mn0  1  0.06249400  0.06249400  0.06249400  1.0
  Cr  Cr1  1  0.75180000  0.75180000  0.75180000  1.0
  Cr  Cr2  1  0.24960400  0.24960400  0.24960400  1.0
  Cr  Cr3  1  0.00356100  0.49666400  0.49666400  1.0
  Cr  Cr4  1  0.50400800  0.99885600  0.99885600  1.0
  Cr  Cr5  1  0.49666400  0.00356100  0.49666400  1.0
  Cr  Cr6  1  0.99885600  0.50400800  0.99885600  1.0
  Cr  Cr7  1  0.49666400  0.49666400  0.00356100  1.0
  Cr  Cr8  1  0.99885600  0.99885600  0.50400800  1.0
  Cu  Cu9  1  0.56240000  0.56240000  0.56240000  1.0
  Cu  Cu10  1  0.43756700  0.43756700  0.43756700  1.0
  Cu  Cu11  1  0.93754600  0.93754600  0.93754600  1.0
  S  S12  1  0.12988000  0.12988000  0.12988000  1.0
  S  S13  1  0.62928400  0.62928400  0.62928400  1.0
  S  S14  1  0.39949200  0.86035600  0.86035600  1.0
  S  S15  1  0.89522500  0.36271700  0.36271700  1.0
  S  S16  1  0.86035600  0.39949200  0.86035600  1.0
  S  S17  1  0.36271700  0.89522500  0.36271700  1.0
  S  S18  1  0.86035600  0.86035600  0.39949200  1.0
  S  S19  1  0.36271700  0.36271700  0.89522500  1.0
  S  S20  1  0.37076400  0.37076400  0.37076400  1.0
  S  S21  1  0.87107800  0.87107800  0.87107800  1.0
  S  S22  1  0.10521700  0.63715400  0.63715400  1.0
  S  S23  1  0.60477800  0.13690500  0.13690500  1.0
  S  S24  1  0.63715400  0.10521700  0.63715400  1.0
  S  S25  1  0.13690500  0.60477800  0.13690500  1.0
  S  S26  1  0.63715400  0.63715400  0.10521700  1.0
  S  S27  1  0.13690500  0.13690500  0.60477800  1.0