# generated using pymatgen
data_Cr5S8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.61185975
_cell_length_b   6.80617235
_cell_length_c   11.08275975
_cell_angle_alpha   90.00000000
_cell_angle_beta   91.42243118
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr5S8
_chemical_formula_sum   'Cr20 S32'
_cell_volume   875.62629218
_cell_formula_units_Z   4
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  0.00070200  0.00000000  0.00088800  1
  Cr  Cr1  1  0.49906900  0.00000000  0.50487500  1
  Cr  Cr2  1  0.98663500  0.00000000  0.26411600  1
  Cr  Cr3  1  0.01270200  0.00000000  0.73877000  1
  Cr  Cr4  1  0.51283800  0.00000000  0.23528600  1
  Cr  Cr5  1  0.49347600  0.00000000  0.75635200  1
  Cr  Cr6  1  0.75002900  0.76757100  0.25017000  1
  Cr  Cr7  1  0.75002900  0.23242900  0.25017000  1
  Cr  Cr8  1  0.24692100  0.22935800  0.75065700  1
  Cr  Cr9  1  0.24692100  0.77064200  0.75065700  1
  Cr  Cr10  1  0.50070200  0.50000000  0.00088800  1
  Cr  Cr11  1  0.99906900  0.50000000  0.50487500  1
  Cr  Cr12  1  0.48663500  0.50000000  0.26411600  1
  Cr  Cr13  1  0.51270200  0.50000000  0.73877000  1
  Cr  Cr14  1  0.01283800  0.50000000  0.23528600  1
  Cr  Cr15  1  0.99347600  0.50000000  0.75635200  1
  Cr  Cr16  1  0.25002900  0.26757100  0.25017000  1
  Cr  Cr17  1  0.25002900  0.73242900  0.25017000  1
  Cr  Cr18  1  0.74692100  0.72935800  0.75065700  1
  Cr  Cr19  1  0.74692100  0.27064200  0.75065700  1
  S  S20  1  0.83876000  0.00000000  0.86024900  1
  S  S21  1  0.17078100  0.00000000  0.61815800  1
  S  S22  1  0.82659400  0.00000000  0.38120800  1
  S  S23  1  0.33975200  0.00000000  0.36047600  1
  S  S24  1  0.66243600  0.00000000  0.63941400  1
  S  S25  1  0.33227200  0.00000000  0.87640700  1
  S  S26  1  0.67365600  0.00000000  0.11901800  1
  S  S27  1  0.58243900  0.24219500  0.37278300  1
  S  S28  1  0.58243900  0.75780500  0.37278300  1
  S  S29  1  0.41448100  0.75379300  0.62740100  1
  S  S30  1  0.41448100  0.24620700  0.62740100  1
  S  S31  1  0.58384000  0.25488800  0.87476100  1
  S  S32  1  0.58384000  0.74511200  0.87476100  1
  S  S33  1  0.41688400  0.74298700  0.12671900  1
  S  S34  1  0.41688400  0.25701300  0.12671900  1
  S  S35  1  0.16114100  0.00000000  0.13980000  1
  S  S36  1  0.33876000  0.50000000  0.86024900  1
  S  S37  1  0.67078100  0.50000000  0.61815800  1
  S  S38  1  0.32659400  0.50000000  0.38120800  1
  S  S39  1  0.83975200  0.50000000  0.36047600  1
  S  S40  1  0.16243600  0.50000000  0.63941400  1
  S  S41  1  0.83227200  0.50000000  0.87640700  1
  S  S42  1  0.17365600  0.50000000  0.11901800  1
  S  S43  1  0.08243900  0.74219500  0.37278300  1
  S  S44  1  0.08243900  0.25780500  0.37278300  1
  S  S45  1  0.91448100  0.25379300  0.62740100  1
  S  S46  1  0.91448100  0.74620700  0.62740100  1
  S  S47  1  0.08384000  0.75488800  0.87476100  1
  S  S48  1  0.08384000  0.24511200  0.87476100  1
  S  S49  1  0.91688400  0.24298700  0.12671900  1
  S  S50  1  0.91688400  0.75701300  0.12671900  1
  S  S51  1  0.66114100  0.50000000  0.13980000  1
