# generated using pymatgen
data_Cr8Fe2CuNiS16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.92528536
_cell_length_b   11.92528536
_cell_length_c   11.92528570
_cell_angle_alpha   33.52625630
_cell_angle_beta   33.52625630
_cell_angle_gamma   33.52625481
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr8Fe2CuNiS16
_chemical_formula_sum   'Cr8 Fe2 Cu1 Ni1 S16'
_cell_volume   460.79437547
_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
  Cr  Cr0  1  0.74981400  0.74981400  0.74981400  1.0
  Cr  Cr1  1  0.24891000  0.24891000  0.24891000  1.0
  Cr  Cr2  1  0.49749700  0.00205300  0.00205300  1.0
  Cr  Cr3  1  0.99740500  0.50106100  0.50106100  1.0
  Cr  Cr4  1  0.50106100  0.99740500  0.50106100  1.0
  Cr  Cr5  1  0.00205300  0.49749700  0.00205300  1.0
  Cr  Cr6  1  0.50106100  0.50106100  0.99740500  1.0
  Cr  Cr7  1  0.00205300  0.00205300  0.49749700  1.0
  Fe  Fe8  1  0.43742200  0.43742200  0.43742200  1.0
  Fe  Fe9  1  0.93751400  0.93751400  0.93751400  1.0
  Cu  Cu10  1  0.06259400  0.06259400  0.06259400  1.0
  Ni  Ni11  1  0.56245800  0.56245800  0.56245800  1.0
  S  S12  1  0.12913100  0.12913100  0.12913100  1.0
  S  S13  1  0.62730000  0.62730000  0.62730000  1.0
  S  S14  1  0.39459200  0.86303800  0.86303800  1.0
  S  S15  1  0.88727900  0.36784300  0.36784400  1.0
  S  S16  1  0.86303800  0.39459200  0.86303800  1.0
  S  S17  1  0.36784300  0.88727900  0.36784300  1.0
  S  S18  1  0.86303800  0.86303800  0.39459200  1.0
  S  S19  1  0.36784400  0.36784400  0.88727900  1.0
  S  S20  1  0.37339300  0.37339300  0.37339300  1.0
  S  S21  1  0.87343000  0.87343000  0.87343000  1.0
  S  S22  1  0.11737200  0.62993100  0.62993100  1.0
  S  S23  1  0.61682800  0.12960400  0.12960400  1.0
  S  S24  1  0.62993100  0.11737200  0.62993100  1.0
  S  S25  1  0.12960400  0.61682800  0.12960400  1.0
  S  S26  1  0.62993100  0.62993100  0.11737200  1.0
  S  S27  1  0.12960400  0.12960400  0.61682800  1.0