# generated using pymatgen
data_Nb5Cr3Se20
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.54350600
_cell_length_b   17.35538821
_cell_length_c   10.51947627
_cell_angle_alpha   82.13936969
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb5Cr3Se20
_chemical_formula_sum   'Nb5 Cr3 Se20'
_cell_volume   640.85762581
_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
  Nb  Nb0  1  0.75000000  0.36212400  0.27182700  1.0
  Nb  Nb1  1  0.75000000  0.86209300  0.77512700  1.0
  Nb  Nb2  1  0.25000000  0.13848900  0.22097300  1.0
  Nb  Nb3  1  0.25000000  0.63783300  0.72498000  1.0
  Nb  Nb4  1  0.25000000  0.27561800  0.63677200  1.0
  Cr  Cr5  1  0.25000000  0.78112900  0.11088600  1.0
  Cr  Cr6  1  0.75000000  0.22359300  0.87853400  1.0
  Cr  Cr7  1  0.75000000  0.71885300  0.38928000  1.0
  Se  Se8  1  0.25000000  0.47885200  0.27910700  1.0
  Se  Se9  1  0.25000000  0.97783200  0.78120300  1.0
  Se  Se10  1  0.75000000  0.02173200  0.21531100  1.0
  Se  Se11  1  0.75000000  0.52192600  0.71952400  1.0
  Se  Se12  1  0.25000000  0.25649600  0.37531700  1.0
  Se  Se13  1  0.25000000  0.75638500  0.87715400  1.0
  Se  Se14  1  0.75000000  0.24331500  0.11676400  1.0
  Se  Se15  1  0.75000000  0.74352700  0.62305500  1.0
  Se  Se16  1  0.25000000  0.41812900  0.08960300  1.0
  Se  Se17  1  0.25000000  0.91674400  0.59111400  1.0
  Se  Se18  1  0.75000000  0.08362200  0.40403800  1.0
  Se  Se19  1  0.75000000  0.58336600  0.90915900  1.0
  Se  Se20  1  0.75000000  0.37910900  0.53052500  1.0
  Se  Se21  1  0.75000000  0.88080900  0.03029200  1.0
  Se  Se22  1  0.25000000  0.12565200  0.96196500  1.0
  Se  Se23  1  0.25000000  0.61912000  0.46991800  1.0
  Se  Se24  1  0.75000000  0.16527300  0.67202800  1.0
  Se  Se25  1  0.75000000  0.67927900  0.17115000  1.0
  Se  Se26  1  0.25000000  0.32850100  0.84528200  1.0
  Se  Se27  1  0.25000000  0.82059800  0.32911100  1.0