# generated using pymatgen
data_Cr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.52431337
_cell_length_b   9.09994636
_cell_length_c   46.60754639
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   82.04678546
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr
_chemical_formula_sum   Cr40
_cell_volume   1060.3294125
_cell_formula_units_Z   40
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  Cr1  1  0.508515  0.982901  0.305129  1
  Cr  Cr2  1  0.745019  0.509706  0.283533  1
  Cr  Cr3  1  0.136656  0.726540  0.308392  1
  Cr  Cr4  1  0.369764  0.259923  0.286907  1
  Cr  Cr5  1  0.038085  0.923688  0.350537  1
  Cr  Cr6  1  0.274655  0.450421  0.328590  1
  Cr  Cr7  1  0.665398  0.668982  0.353855  1
  Cr  Cr8  1  0.901487  0.196654  0.331874  1
  Cr  Cr9  1  0.567335  0.865116  0.396007  1
  Cr  Cr10  1  0.803005  0.393708  0.373779  1
  Cr  Cr11  1  0.194506  0.610705  0.399592  1
  Cr  Cr12  1  0.430214  0.139221  0.377300  1
  Cr  Cr13  1  0.096332  0.807066  0.441551  1
  Cr  Cr14  1  0.331970  0.335752  0.419143  1
  Cr  Cr15  1  0.723608  0.552447  0.445216  1
  Cr  Cr16  1  0.959314  0.081001  0.422757  1
  Cr  Cr17  1  0.625364  0.748952  0.487079  1
  Cr  Cr18  1  0.860991  0.277676  0.464580  1
  Cr  Cr19  1  0.252687  0.494243  0.490770  1
  Cr  Cr20  1  0.488315  0.022965  0.468259  1
  Cr  Cr21  1  0.154392  0.690855  0.532595  1
  Cr  Cr22  1  0.390020  0.219578  0.510083  1
  Cr  Cr23  1  0.781716  0.436145  0.536274  1
  Cr  Cr24  1  0.017343  0.964868  0.513774  1
  Cr  Cr25  1  0.683393  0.632820  0.578097  1
  Cr  Cr26  1  0.919099  0.161374  0.555638  1
  Cr  Cr27  1  0.310737  0.378068  0.581710  1
  Cr  Cr28  1  0.546375  0.906755  0.559303  1
  Cr  Cr29  1  0.212493  0.574599  0.623554  1
  Cr  Cr30  1  0.448201  0.103115  0.601261  1
  Cr  Cr31  1  0.839702  0.320112  0.627074  1
  Cr  Cr32  1  0.075372  0.848704  0.604846  1
  Cr  Cr33  1  0.741220  0.517167  0.668979  1
  Cr  Cr34  1  0.977309  0.044839  0.646998  1
  Cr  Cr35  1  0.368052  0.263400  0.672264  1
  Cr  Cr36  1  0.604622  0.790132  0.650316  1
  Cr  Cr37  1  0.272943  0.453897  0.713946  1
  Cr  Cr38  1  0.506051  0.987280  0.692462  1
  Cr  Cr39  1  0.897688  0.204115  0.717320  1
  Cr  Cr40  1  0.134192  0.730919  0.695724  1
