# generated using pymatgen
data_Cr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.01047925
_cell_length_b   7.87889083
_cell_length_c   47.23258924
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   108.43494882
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr
_chemical_formula_sum   Cr72
_cell_volume   1768.91660862
_cell_formula_units_Z   72
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  0.172049  0.341400  0.297850  1
  Cr  Cr2  1  0.391051  0.780007  0.325139  1
  Cr  Cr3  1  0.062882  0.629453  0.285667  1
  Cr  Cr4  1  0.274698  0.057098  0.311828  1
  Cr  Cr5  1  0.569333  0.629235  0.285683  1
  Cr  Cr6  1  0.784775  0.057162  0.311824  1
  Cr  Cr7  1  0.666855  0.330975  0.297041  1
  Cr  Cr8  1  0.460659  0.918328  0.273133  1
  Cr  Cr9  1  0.613901  0.226456  0.348785  1
  Cr  Cr10  1  0.835149  0.669676  0.373772  1
  Cr  Cr11  1  0.503196  0.502362  0.336116  1
  Cr  Cr12  1  0.725135  0.949246  0.361836  1
  Cr  Cr13  1  0.000775  0.502393  0.336106  1
  Cr  Cr14  1  0.225121  0.949239  0.361838  1
  Cr  Cr15  1  0.114453  0.227571  0.349171  1
  Cr  Cr16  1  0.892361  0.782686  0.324274  1
  Cr  Cr17  1  0.057344  0.114629  0.399131  1
  Cr  Cr18  1  0.278650  0.557903  0.423913  1
  Cr  Cr19  1  0.945677  0.391904  0.386390  1
  Cr  Cr20  1  0.167787  0.836023  0.411460  1
  Cr  Cr21  1  0.446585  0.391892  0.386395  1
  Cr  Cr22  1  0.667932  0.836028  0.411459  1
  Cr  Cr23  1  0.557437  0.114799  0.399055  1
  Cr  Cr24  1  0.334625  0.668655  0.374074  1
  Cr  Cr25  1  0.500526  0.002290  0.448916  1
  Cr  Cr26  1  0.722271  0.446398  0.473852  1
  Cr  Cr27  1  0.389861  0.280441  0.436460  1
  Cr  Cr28  1  0.611358  0.724196  0.461351  1
  Cr  Cr29  1  0.889685  0.280446  0.436458  1
  Cr  Cr30  1  0.111286  0.724195  0.461351  1
  Cr  Cr31  1  0.000516  0.002275  0.448937  1
  Cr  Cr32  1  0.778765  0.558121  0.423827  1
  Cr  Cr33  1  0.943941  0.890385  0.498829  1
  Cr  Cr34  1  0.165643  0.334428  0.523779  1
  Cr  Cr35  1  0.833069  0.168390  0.486363  1
  Cr  Cr36  1  0.054755  0.612388  0.511285  1
  Cr  Cr37  1  0.333132  0.168389  0.486364  1
  Cr  Cr38  1  0.554819  0.612387  0.511285  1
  Cr  Cr39  1  0.443946  0.890392  0.498819  1
  Cr  Cr40  1  0.222245  0.446348  0.473869  1
  Cr  Cr41  1  0.387372  0.778501  0.548711  1
  Cr  Cr42  1  0.609123  0.222656  0.573822  1
  Cr  Cr43  1  0.276602  0.056582  0.536297  1
  Cr  Cr44  1  0.498203  0.500331  0.561190  1
  Cr  Cr45  1  0.776530  0.056581  0.536297  1
  Cr  Cr46  1  0.998027  0.500336  0.561189  1
  Cr  Cr47  1  0.887362  0.778486  0.548733  1
  Cr  Cr48  1  0.665617  0.334379  0.523796  1
  Cr  Cr49  1  0.830451  0.665978  0.598593  1
  Cr  Cr50  1  0.053263  0.112122  0.623575  1
  Cr  Cr51  1  0.719955  0.944748  0.586189  1
  Cr  Cr52  1  0.941303  0.388885  0.611253  1
  Cr  Cr53  1  0.220101  0.944753  0.586188  1
  Cr  Cr54  1  0.442211  0.388873  0.611258  1
  Cr  Cr55  1  0.330544  0.666147  0.598517  1
  Cr  Cr56  1  0.109238  0.222874  0.573735  1
  Cr  Cr57  1  0.273435  0.553206  0.648478  1
  Cr  Cr58  1  0.495527  0.998090  0.673374  1
  Cr  Cr59  1  0.162767  0.831537  0.635811  1
  Cr  Cr60  1  0.387113  0.278383  0.661543  1
  Cr  Cr61  1  0.662753  0.831531  0.635812  1
  Cr  Cr62  1  0.884692  0.278415  0.661532  1
  Cr  Cr63  1  0.773987  0.554321  0.648863  1
  Cr  Cr64  1  0.552738  0.111100  0.623877  1
  Cr  Cr65  1  0.721033  0.449802  0.700608  1
  Cr  Cr66  1  0.927229  0.862449  0.724516  1
  Cr  Cr67  1  0.603113  0.723615  0.685824  1
  Cr  Cr68  1  0.818555  0.151542  0.711965  1
  Cr  Cr69  1  0.113190  0.723679  0.685820  1
  Cr  Cr70  1  0.325006  0.151324  0.711981  1
  Cr  Cr71  1  0.215839  0.439377  0.699798  1
  Cr  Cr72  1  0.996837  1.000770  0.672510  1
