# generated using pymatgen
data_Cr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.92225874
_cell_length_b   4.81534978
_cell_length_c   48.21251439
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   69.06461297
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr
_chemical_formula_sum   Cr78
_cell_volume   1934.64754051
_cell_formula_units_Z   78
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  0.876379  0.487572  0.279602  1
  Cr  Cr2  1  0.165464  0.380837  0.291905  1
  Cr  Cr3  1  0.452930  0.316213  0.302219  1
  Cr  Cr4  1  0.757440  0.074934  0.272444  1
  Cr  Cr5  1  0.065532  0.932941  0.281919  1
  Cr  Cr6  1  0.365581  0.852586  0.292792  1
  Cr  Cr7  1  0.721555  0.285201  0.318236  1
  Cr  Cr8  1  0.998826  0.234073  0.327134  1
  Cr  Cr9  1  0.281034  0.173677  0.338335  1
  Cr  Cr10  1  0.645223  0.805901  0.307091  1
  Cr  Cr11  1  0.924976  0.776392  0.319471  1
  Cr  Cr12  1  0.207172  0.716878  0.329581  1
  Cr  Cr13  1  0.557051  0.121603  0.351095  1
  Cr  Cr14  1  0.837592  0.074342  0.362989  1
  Cr  Cr15  1  0.117078  0.018061  0.373253  1
  Cr  Cr16  1  0.484446  0.663102  0.341696  1
  Cr  Cr17  1  0.767434  0.619895  0.353776  1
  Cr  Cr18  1  0.048929  0.558130  0.364581  1
  Cr  Cr19  1  0.394824  0.965790  0.385116  1
  Cr  Cr20  1  0.673905  0.914622  0.397103  1
  Cr  Cr21  1  0.954572  0.860234  0.408181  1
  Cr  Cr22  1  0.326148  0.507243  0.376115  1
  Cr  Cr23  1  0.606340  0.456762  0.387398  1
  Cr  Cr24  1  0.886833  0.403737  0.399214  1
  Cr  Cr25  1  0.233079  0.807992  0.419553  1
  Cr  Cr26  1  0.512239  0.754731  0.431115  1
  Cr  Cr27  1  0.791919  0.702858  0.442681  1
  Cr  Cr28  1  0.165838  0.349033  0.410515  1
  Cr  Cr29  1  0.444975  0.297535  0.421824  1
  Cr  Cr30  1  0.724638  0.245573  0.433293  1
  Cr  Cr31  1  0.071276  0.649677  0.454001  1
  Cr  Cr32  1  0.350595  0.596426  0.465408  1
  Cr  Cr33  1  0.629988  0.543874  0.476929  1
  Cr  Cr34  1  0.003940  0.192105  0.444911  1
  Cr  Cr35  1  0.283403  0.138923  0.456236  1
  Cr  Cr36  1  0.562808  0.086509  0.467587  1
  Cr  Cr37  1  0.909299  0.491694  0.488417  1
  Cr  Cr38  1  0.188733  0.438531  0.499760  1
  Cr  Cr39  1  0.468243  0.385143  0.511189  1
  Cr  Cr40  1  0.842008  0.034375  0.479175  1
  Cr  Cr41  1  0.121519  0.980987  0.490604  1
  Cr  Cr42  1  0.400953  0.927824  0.501947  1
  Cr  Cr43  1  0.747443  0.333009  0.522778  1
  Cr  Cr44  1  0.026849  0.280595  0.534129  1
  Cr  Cr45  1  0.306312  0.227412  0.545453  1
  Cr  Cr46  1  0.680264  0.875644  0.513436  1
  Cr  Cr47  1  0.959657  0.823092  0.524956  1
  Cr  Cr48  1  0.238975  0.769841  0.536364  1
  Cr  Cr49  1  0.585614  0.173945  0.557072  1
  Cr  Cr50  1  0.865276  0.121983  0.568540  1
  Cr  Cr51  1  0.144413  0.070485  0.579850  1
  Cr  Cr52  1  0.518333  0.716660  0.547683  1
  Cr  Cr53  1  0.798012  0.664787  0.559250  1
  Cr  Cr54  1  0.077173  0.611526  0.570812  1
  Cr  Cr55  1  0.423419  0.015781  0.591151  1
  Cr  Cr56  1  0.703912  0.962756  0.602967  1
  Cr  Cr57  1  0.984103  0.912275  0.614250  1
  Cr  Cr58  1  0.355679  0.559284  0.582184  1
  Cr  Cr59  1  0.636347  0.504896  0.593262  1
  Cr  Cr60  1  0.915428  0.453728  0.605248  1
  Cr  Cr61  1  0.261323  0.861388  0.625784  1
  Cr  Cr62  1  0.542817  0.799623  0.636588  1
  Cr  Cr63  1  0.825805  0.756416  0.648669  1
  Cr  Cr64  1  0.193174  0.401457  0.617111  1
  Cr  Cr65  1  0.472659  0.345176  0.627375  1
  Cr  Cr66  1  0.753200  0.297915  0.639269  1
  Cr  Cr67  1  0.103080  0.702640  0.660784  1
  Cr  Cr68  1  0.385276  0.643126  0.670894  1
  Cr  Cr69  1  0.665028  0.613617  0.683273  1
  Cr  Cr70  1  0.029218  0.245841  0.652030  1
  Cr  Cr71  1  0.311426  0.185445  0.663231  1
  Cr  Cr72  1  0.588697  0.134317  0.672129  1
  Cr  Cr73  1  0.944670  0.566932  0.697572  1
  Cr  Cr74  1  0.244719  0.486577  0.708445  1
  Cr  Cr75  1  0.552812  0.344584  0.717920  1
  Cr  Cr76  1  0.857322  0.103305  0.688146  1
  Cr  Cr77  1  0.144788  0.038681  0.698459  1
  Cr  Cr78  1  0.433872  0.931945  0.710762  1
