# generated using pymatgen
data_Cr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.02396686
_cell_length_b   11.08993600
_cell_length_c   48.88371222
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   102.92096638
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr
_chemical_formula_sum   Cr108
_cell_volume   2654.61648437
_cell_formula_units_Z   108
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  0.004947  0.008326  0.315785  1
  Cr  Cr2  1  0.695690  0.389086  0.280312  1
  Cr  Cr3  1  0.845039  0.688025  0.295833  1
  Cr  Cr4  1  0.845039  0.188025  0.295833  1
  Cr  Cr5  1  0.004947  0.508326  0.315785  1
  Cr  Cr6  1  0.695690  0.889086  0.280312  1
  Cr  Cr7  1  0.345039  0.188025  0.295833  1
  Cr  Cr8  1  0.504947  0.508326  0.315785  1
  Cr  Cr9  1  0.195690  0.889086  0.280312  1
  Cr  Cr10  1  0.504947  0.008326  0.315785  1
  Cr  Cr11  1  0.195690  0.389086  0.280312  1
  Cr  Cr12  1  0.345039  0.688025  0.295833  1
  Cr  Cr13  1  0.476152  0.952997  0.364440  1
  Cr  Cr14  1  0.160497  0.320458  0.330696  1
  Cr  Cr15  1  0.320024  0.639809  0.348142  1
  Cr  Cr16  1  0.320024  0.139809  0.348142  1
  Cr  Cr17  1  0.476152  0.452997  0.364440  1
  Cr  Cr18  1  0.160497  0.820458  0.330696  1
  Cr  Cr19  1  0.820024  0.139809  0.348142  1
  Cr  Cr20  1  0.976152  0.452997  0.364440  1
  Cr  Cr21  1  0.660497  0.820458  0.330696  1
  Cr  Cr22  1  0.976152  0.952997  0.364440  1
  Cr  Cr23  1  0.660497  0.320458  0.330696  1
  Cr  Cr24  1  0.820024  0.639809  0.348142  1
  Cr  Cr25  1  0.948972  0.900209  0.414417  1
  Cr  Cr26  1  0.634214  0.269472  0.381209  1
  Cr  Cr27  1  0.791393  0.584556  0.397799  1
  Cr  Cr28  1  0.791393  0.084556  0.397799  1
  Cr  Cr29  1  0.948972  0.400209  0.414417  1
  Cr  Cr30  1  0.634214  0.769472  0.381209  1
  Cr  Cr31  1  0.291393  0.084556  0.397799  1
  Cr  Cr32  1  0.448972  0.400209  0.414417  1
  Cr  Cr33  1  0.134214  0.769472  0.381209  1
  Cr  Cr34  1  0.448972  0.900209  0.414417  1
  Cr  Cr35  1  0.134214  0.269472  0.381209  1
  Cr  Cr36  1  0.291393  0.584556  0.397799  1
  Cr  Cr37  1  0.421277  0.846607  0.464320  1
  Cr  Cr38  1  0.106372  0.215641  0.431067  1
  Cr  Cr39  1  0.263826  0.531110  0.447685  1
  Cr  Cr40  1  0.263826  0.031110  0.447685  1
  Cr  Cr41  1  0.421277  0.346607  0.464320  1
  Cr  Cr42  1  0.106372  0.715641  0.431067  1
  Cr  Cr43  1  0.763826  0.031110  0.447685  1
  Cr  Cr44  1  0.921277  0.346607  0.464320  1
  Cr  Cr45  1  0.606372  0.715641  0.431067  1
  Cr  Cr46  1  0.921277  0.846607  0.464320  1
  Cr  Cr47  1  0.606372  0.215641  0.431067  1
  Cr  Cr48  1  0.763826  0.531110  0.447685  1
  Cr  Cr49  1  0.893617  0.793039  0.514208  1
  Cr  Cr50  1  0.578721  0.162076  0.480947  1
  Cr  Cr51  1  0.736169  0.477558  0.497578  1
  Cr  Cr52  1  0.736169  0.977558  0.497578  1
  Cr  Cr53  1  0.893617  0.293039  0.514208  1
  Cr  Cr54  1  0.578721  0.662076  0.480947  1
  Cr  Cr55  1  0.236169  0.977558  0.497578  1
  Cr  Cr56  1  0.393617  0.293039  0.514208  1
  Cr  Cr57  1  0.078721  0.662076  0.480947  1
  Cr  Cr58  1  0.393617  0.793039  0.514208  1
  Cr  Cr59  1  0.078721  0.162076  0.480947  1
  Cr  Cr60  1  0.236169  0.477558  0.497578  1
  Cr  Cr61  1  0.365966  0.739475  0.564089  1
  Cr  Cr62  1  0.051061  0.108508  0.530836  1
  Cr  Cr63  1  0.208512  0.424006  0.547470  1
  Cr  Cr64  1  0.208512  0.924006  0.547470  1
  Cr  Cr65  1  0.365966  0.239475  0.564089  1
  Cr  Cr66  1  0.051061  0.608508  0.530836  1
  Cr  Cr67  1  0.708512  0.924006  0.547470  1
  Cr  Cr68  1  0.865966  0.239475  0.564089  1
  Cr  Cr69  1  0.551061  0.608508  0.530836  1
  Cr  Cr70  1  0.865966  0.739475  0.564089  1
  Cr  Cr71  1  0.551061  0.108508  0.530836  1
  Cr  Cr72  1  0.708512  0.424006  0.547470  1
  Cr  Cr73  1  0.838124  0.685643  0.613946  1
  Cr  Cr74  1  0.523365  0.054906  0.580738  1
  Cr  Cr75  1  0.680945  0.370559  0.597356  1
  Cr  Cr76  1  0.680945  0.870559  0.597356  1
  Cr  Cr77  1  0.838124  0.185643  0.613946  1
  Cr  Cr78  1  0.523365  0.554906  0.580738  1
  Cr  Cr79  1  0.180945  0.870559  0.597356  1
  Cr  Cr80  1  0.338124  0.185643  0.613946  1
  Cr  Cr81  1  0.023365  0.554906  0.580738  1
  Cr  Cr82  1  0.338124  0.685643  0.613946  1
  Cr  Cr83  1  0.023365  0.054906  0.580738  1
  Cr  Cr84  1  0.180945  0.370559  0.597356  1
  Cr  Cr85  1  0.311841  0.634657  0.664459  1
  Cr  Cr86  1  0.996186  1.002119  0.630716  1
  Cr  Cr87  1  0.152314  0.315306  0.647013  1
  Cr  Cr88  1  0.152314  0.815306  0.647013  1
  Cr  Cr89  1  0.311841  0.134657  0.664459  1
  Cr  Cr90  1  0.996186  0.502119  0.630716  1
  Cr  Cr91  1  0.652314  0.815306  0.647013  1
  Cr  Cr92  1  0.811841  0.134657  0.664459  1
  Cr  Cr93  1  0.496186  0.502119  0.630716  1
  Cr  Cr94  1  0.811841  0.634657  0.664459  1
  Cr  Cr95  1  0.496186  1.002119  0.630716  1
  Cr  Cr96  1  0.652314  0.315306  0.647013  1
  Cr  Cr97  1  0.776648  0.566029  0.714843  1
  Cr  Cr98  1  0.467391  0.946789  0.679370  1
  Cr  Cr99  1  0.627298  0.267091  0.699322  1
  Cr  Cr100  1  0.627298  0.767091  0.699322  1
  Cr  Cr101  1  0.776648  0.066029  0.714843  1
  Cr  Cr102  1  0.467391  0.446789  0.679370  1
  Cr  Cr103  1  0.127298  0.767091  0.699322  1
  Cr  Cr104  1  0.276648  0.066029  0.714843  1
  Cr  Cr105  1  0.967391  0.446789  0.679370  1
  Cr  Cr106  1  0.276648  0.566029  0.714843  1
  Cr  Cr107  1  0.967391  0.946789  0.679370  1
  Cr  Cr108  1  0.127298  0.267091  0.699322  1
