# generated using pymatgen
data_Cr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.35305771
_cell_length_b   13.35380402
_cell_length_c   45.25926364
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   99.39736164
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr
_chemical_formula_sum   Cr96
_cell_volume   2595.60782053
_cell_formula_units_Z   96
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  0.749411  0.159737  0.284603  1
  Cr  Cr2  1  0.911522  0.486130  0.293721  1
  Cr  Cr3  1  0.078584  0.818840  0.302007  1
  Cr  Cr4  1  0.336032  0.997628  0.280571  1
  Cr  Cr5  1  0.498087  0.322180  0.289250  1
  Cr  Cr6  1  0.667276  0.650373  0.298338  1
  Cr  Cr7  1  0.241197  0.147896  0.312048  1
  Cr  Cr8  1  0.407196  0.477917  0.321156  1
  Cr  Cr9  1  0.573624  0.808206  0.329610  1
  Cr  Cr10  1  0.828553  0.983289  0.307415  1
  Cr  Cr11  1  0.994495  0.313223  0.316716  1
  Cr  Cr12  1  0.161036  0.642969  0.325569  1
  Cr  Cr13  1  0.736503  0.137912  0.339864  1
  Cr  Cr14  1  0.902945  0.469126  0.349186  1
  Cr  Cr15  1  0.069091  0.799386  0.357845  1
  Cr  Cr16  1  0.323397  0.972863  0.335563  1
  Cr  Cr17  1  0.489312  0.303641  0.344658  1
  Cr  Cr18  1  0.655174  0.634208  0.353726  1
  Cr  Cr19  1  0.233329  0.129559  0.367363  1
  Cr  Cr20  1  0.399001  0.460013  0.376541  1
  Cr  Cr21  1  0.564867  0.790677  0.385390  1
  Cr  Cr22  1  0.818509  0.964404  0.362813  1
  Cr  Cr23  1  0.983507  0.294673  0.371990  1
  Cr  Cr24  1  0.149510  0.625334  0.381073  1
  Cr  Cr25  1  0.729402  0.120559  0.395295  1
  Cr  Cr26  1  0.894996  0.450963  0.404500  1
  Cr  Cr27  1  0.060321  0.781301  0.413481  1
  Cr  Cr28  1  0.313190  0.955452  0.390799  1
  Cr  Cr29  1  0.478288  0.285746  0.399967  1
  Cr  Cr30  1  0.643791  0.616187  0.409061  1
  Cr  Cr31  1  0.225039  0.111591  0.423057  1
  Cr  Cr32  1  0.390567  0.441978  0.432224  1
  Cr  Cr33  1  0.555795  0.772357  0.441268  1
  Cr  Cr34  1  0.808255  0.946355  0.418443  1
  Cr  Cr35  1  0.973452  0.276765  0.427672  1
  Cr  Cr36  1  0.138816  0.607143  0.436790  1
  Cr  Cr37  1  0.720595  0.102510  0.450890  1
  Cr  Cr38  1  0.886007  0.432928  0.460075  1
  Cr  Cr39  1  0.051206  0.763264  0.469193  1
  Cr  Cr40  1  0.303459  0.937338  0.446322  1
  Cr  Cr41  1  0.468708  0.267716  0.455522  1
  Cr  Cr42  1  0.633995  0.598119  0.464653  1
  Cr  Cr43  1  0.216060  0.093491  0.478688  1
  Cr  Cr44  1  0.381394  0.423901  0.487848  1
  Cr  Cr45  1  0.546618  0.754264  0.496999  1
  Cr  Cr46  1  0.798803  0.928318  0.474091  1
  Cr  Cr47  1  0.964034  0.258681  0.483288  1
  Cr  Cr48  1  0.129334  0.589090  0.492445  1
  Cr  Cr49  1  0.711457  0.084450  0.506517  1
  Cr  Cr50  1  0.876758  0.414859  0.515674  1
  Cr  Cr51  1  0.041988  0.745222  0.524872  1
  Cr  Cr52  1  0.294173  0.919276  0.501963  1
  Cr  Cr53  1  0.459397  0.249639  0.511115  1
  Cr  Cr54  1  0.624732  0.580049  0.520274  1
  Cr  Cr55  1  0.206797  0.075421  0.534309  1
  Cr  Cr56  1  0.372083  0.405824  0.543441  1
  Cr  Cr57  1  0.537333  0.736202  0.552641  1
  Cr  Cr58  1  0.789586  0.910276  0.529769  1
  Cr  Cr59  1  0.954785  0.240612  0.538888  1
  Cr  Cr60  1  0.120196  0.571030  0.548073  1
  Cr  Cr61  1  0.701976  0.066397  0.562173  1
  Cr  Cr62  1  0.867340  0.396775  0.571291  1
  Cr  Cr63  1  0.032537  0.727185  0.580520  1
  Cr  Cr64  1  0.284996  0.901183  0.557695  1
  Cr  Cr65  1  0.450225  0.231562  0.566738  1
  Cr  Cr66  1  0.615752  0.561949  0.575905  1
  Cr  Cr67  1  0.197001  0.057353  0.589902  1
  Cr  Cr68  1  0.362503  0.387794  0.598995  1
  Cr  Cr69  1  0.527601  0.718088  0.608164  1
  Cr  Cr70  1  0.780471  0.892239  0.585481  1
  Cr  Cr71  1  0.945796  0.222577  0.594463  1
  Cr  Cr72  1  0.111390  0.552981  0.603667  1
  Cr  Cr73  1  0.691282  0.048206  0.617889  1
  Cr  Cr74  1  0.857285  0.378867  0.626972  1
  Cr  Cr75  1  0.022282  0.709136  0.636149  1
  Cr  Cr76  1  0.275925  0.882863  0.613572  1
  Cr  Cr77  1  0.441790  0.213527  0.622422  1
  Cr  Cr78  1  0.607462  0.543981  0.631600  1
  Cr  Cr79  1  0.185617  0.039332  0.645237  1
  Cr  Cr80  1  0.351480  0.369899  0.654305  1
  Cr  Cr81  1  0.517395  0.700677  0.663400  1
  Cr  Cr82  1  0.771701  0.874154  0.641118  1
  Cr  Cr83  1  0.937846  0.204414  0.649777  1
  Cr  Cr84  1  0.104289  0.535628  0.659098  1
  Cr  Cr85  1  0.679756  0.030571  0.673394  1
  Cr  Cr86  1  0.846296  0.360317  0.682246  1
  Cr  Cr87  1  0.012238  0.690251  0.691548  1
  Cr  Cr88  1  0.267167  0.865334  0.669352  1
  Cr  Cr89  1  0.433596  0.195623  0.677807  1
  Cr  Cr90  1  0.599595  0.525644  0.686915  1
  Cr  Cr91  1  0.173516  0.023167  0.700625  1
  Cr  Cr92  1  0.342704  0.351360  0.709712  1
  Cr  Cr93  1  0.504759  0.675912  0.718392  1
  Cr  Cr94  1  0.762208  0.854700  0.696956  1
  Cr  Cr95  1  0.929270  0.187410  0.705241  1
  Cr  Cr96  1  0.091381  0.513803  0.714360  1
