# generated using pymatgen
data_Cr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.46610605
_cell_length_b   12.84051945
_cell_length_c   47.60992702
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr
_chemical_formula_sum   Cr84
_cell_volume   2118.95608011
_cell_formula_units_Z   84
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  0.009810  0.427062  0.296240  1
  Cr  Cr2  1  0.009810  0.037671  0.317311  1
  Cr  Cr3  1  0.009810  0.650512  0.338545  1
  Cr  Cr4  1  0.509810  0.537106  0.317704  1
  Cr  Cr5  1  0.509810  0.313786  0.274099  1
  Cr  Cr6  1  0.509810  0.921408  0.294034  1
  Cr  Cr7  1  0.509810  0.344354  0.328387  1
  Cr  Cr8  1  0.509810  0.117085  0.284157  1
  Cr  Cr9  1  0.509810  0.731924  0.306503  1
  Cr  Cr10  1  0.009810  0.618382  0.283976  1
  Cr  Cr11  1  0.009810  0.231341  0.307380  1
  Cr  Cr12  1  0.009810  0.843956  0.327675  1
  Cr  Cr13  1  0.009810  0.265665  0.359255  1
  Cr  Cr14  1  0.009810  0.881004  0.379644  1
  Cr  Cr15  1  0.009810  0.496547  0.400843  1
  Cr  Cr16  1  0.509810  0.380992  0.380143  1
  Cr  Cr17  1  0.509810  0.151462  0.338378  1
  Cr  Cr18  1  0.509810  0.765308  0.359202  1
  Cr  Cr19  1  0.509810  0.188538  0.390276  1
  Cr  Cr20  1  0.509810  0.958066  0.348382  1
  Cr  Cr21  1  0.509810  0.573233  0.369634  1
  Cr  Cr22  1  0.009810  0.457952  0.349117  1
  Cr  Cr23  1  0.009810  0.073142  0.369227  1
  Cr  Cr24  1  0.009810  0.688781  0.390363  1
  Cr  Cr25  1  0.009810  0.111536  0.421300  1
  Cr  Cr26  1  0.009810  0.727186  0.442237  1
  Cr  Cr27  1  0.009810  0.342350  0.462987  1
  Cr  Cr28  1  0.509810  0.226946  0.442171  1
  Cr  Cr29  1  0.509810  -0.003745  0.400444  1
  Cr  Cr30  1  0.509810  0.611905  0.421506  1
  Cr  Cr31  1  0.509810  0.034645  0.452479  1
  Cr  Cr32  1  0.509810  0.804226  0.411022  1
  Cr  Cr33  1  0.509810  0.419444  0.431926  1
  Cr  Cr34  1  0.009810  0.304031  0.411132  1
  Cr  Cr35  1  0.009810  0.919389  0.431707  1
  Cr  Cr36  1  0.009810  0.534832  0.452645  1
  Cr  Cr37  1  0.009810  0.957779  0.483721  1
  Cr  Cr38  1  0.009810  0.573096  0.504473  1
  Cr  Cr39  1  0.009810  0.188320  0.525253  1
  Cr  Cr40  1  0.509810  0.073043  0.504496  1
  Cr  Cr41  1  0.509810  0.842502  0.462964  1
  Cr  Cr42  1  0.509810  0.457727  0.483745  1
  Cr  Cr43  1  0.509810  0.880871  0.514929  1
  Cr  Cr44  1  0.509810  0.650170  0.473374  1
  Cr  Cr45  1  0.509810  0.265298  0.494082  1
  Cr  Cr46  1  0.009810  0.149952  0.473289  1
  Cr  Cr47  1  0.009810  0.765525  0.494136  1
  Cr  Cr48  1  0.009810  0.380652  0.514843  1
  Cr  Cr49  1  0.009810  0.803877  0.546047  1
  Cr  Cr50  1  0.009810  0.418918  0.566711  1
  Cr  Cr51  1  0.009810  0.034567  0.587773  1
  Cr  Cr52  1  0.509810  0.919287  0.566918  1
  Cr  Cr53  1  0.509810  0.688472  0.525231  1
  Cr  Cr54  1  0.509810  0.303636  0.545980  1
  Cr  Cr55  1  0.509810  0.726791  0.577085  1
  Cr  Cr56  1  0.509810  0.495990  0.535573  1
  Cr  Cr57  1  0.509810  0.111434  0.556511  1
  Cr  Cr58  1  0.009810  0.996177  0.535739  1
  Cr  Cr59  1  0.009810  0.611378  0.556292  1
  Cr  Cr60  1  0.009810  0.226596  0.577196  1
  Cr  Cr61  1  0.009810  0.649830  0.608075  1
  Cr  Cr62  1  0.009810  0.265515  0.629016  1
  Cr  Cr63  1  0.009810  0.879361  0.649840  1
  Cr  Cr64  1  0.509810  0.765157  0.628962  1
  Cr  Cr65  1  0.509810  0.534275  0.587375  1
  Cr  Cr66  1  0.509810  0.149818  0.608573  1
  Cr  Cr67  1  0.509810  0.572871  0.639101  1
  Cr  Cr68  1  0.509810  0.342041  0.597855  1
  Cr  Cr69  1  0.509810  0.957680  0.618990  1
  Cr  Cr70  1  0.009810  0.842284  0.597942  1
  Cr  Cr71  1  0.009810  0.457590  0.618584  1
  Cr  Cr72  1  0.009810  0.072756  0.639836  1
  Cr  Cr73  1  0.009810  0.493716  0.670514  1
  Cr  Cr74  1  0.009810  0.109414  0.694183  1
  Cr  Cr75  1  0.009810  0.717036  0.714118  1
  Cr  Cr76  1  0.509810  0.603760  0.691978  1
  Cr  Cr77  1  0.509810  0.380310  0.649672  1
  Cr  Cr78  1  0.509810  0.993151  0.670907  1
  Cr  Cr79  1  0.509810  0.412441  0.704242  1
  Cr  Cr80  1  0.509810  0.186866  0.660542  1
  Cr  Cr81  1  0.509810  0.799482  0.680837  1
  Cr  Cr82  1  0.009810  0.686469  0.659831  1
  Cr  Cr83  1  0.009810  0.298899  0.681715  1
  Cr  Cr84  1  0.009810  0.913738  0.704061  1
