# generated using pymatgen
data_Cr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.48588168
_cell_length_b   10.32894597
_cell_length_c   46.16527571
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   72.07978686
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr
_chemical_formula_sum   Cr180
_cell_volume   4757.4995444
_cell_formula_units_Z   180
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  0.441318  0.788570  0.331744  1
  Cr  Cr2  1  0.899338  0.581878  0.292248  1
  Cr  Cr3  1  0.831614  0.833802  0.311938  1
  Cr  Cr4  1  0.217137  0.908433  0.310699  1
  Cr  Cr5  1  0.532587  0.555488  0.310370  1
  Cr  Cr6  1  0.823411  0.173830  0.289866  1
  Cr  Cr7  1  0.246731  0.201118  0.295312  1
  Cr  Cr8  1  0.140568  0.471959  0.310281  1
  Cr  Cr9  1  0.494901  0.163894  0.311305  1
  Cr  Cr10  1  0.675087  0.006018  0.279981  1
  Cr  Cr11  1  0.064391  0.733816  0.300185  1
  Cr  Cr12  1  0.974793  0.987417  0.321241  1
  Cr  Cr13  1  0.425349  0.960725  0.288476  1
  Cr  Cr14  1  0.652358  0.722024  0.296977  1
  Cr  Cr15  1  0.981678  0.321429  0.300069  1
  Cr  Cr16  1  0.383329  0.397716  0.300622  1
  Cr  Cr17  1  0.287607  0.642886  0.321277  1
  Cr  Cr18  1  0.637418  0.319785  0.321672  1
  Cr  Cr19  1  0.330397  0.676524  0.372273  1
  Cr  Cr20  1  0.779381  0.482177  0.329919  1
  Cr  Cr21  1  0.710332  0.727088  0.351324  1
  Cr  Cr22  1  0.095653  0.780340  0.351911  1
  Cr  Cr23  1  0.425762  0.442098  0.351797  1
  Cr  Cr24  1  0.733222  0.076562  0.332582  1
  Cr  Cr25  1  0.120067  0.134699  0.333910  1
  Cr  Cr26  1  0.027884  0.379082  0.350622  1
  Cr  Cr27  1  0.379376  0.047713  0.347446  1
  Cr  Cr28  1  0.594054  0.928655  0.325712  1
  Cr  Cr29  1  0.948036  0.625645  0.342611  1
  Cr  Cr30  1  0.862312  0.877420  0.362414  1
  Cr  Cr31  1  0.241797  0.919553  0.364317  1
  Cr  Cr32  1  0.569968  0.591664  0.361894  1
  Cr  Cr33  1  0.875223  0.230871  0.341831  1
  Cr  Cr34  1  0.277599  0.289319  0.343897  1
  Cr  Cr35  1  0.181925  0.531087  0.360588  1
  Cr  Cr36  1  0.528392  0.207970  0.361837  1
  Cr  Cr37  1  0.225214  0.572340  0.411641  1
  Cr  Cr38  1  0.680005  0.360742  0.372326  1
  Cr  Cr39  1  0.615387  0.634751  0.411943  1
  Cr  Cr40  1  0.988012  0.669290  0.392546  1
  Cr  Cr41  1  0.321464  0.336097  0.393054  1
  Cr  Cr42  1  0.626779  0.973568  0.373345  1
  Cr  Cr43  1  0.008814  0.029557  0.372789  1
  Cr  Cr44  1  0.927007  0.273092  0.391082  1
  Cr  Cr45  1  0.287652  0.963255  0.413799  1
  Cr  Cr46  1  0.484597  0.832974  0.381678  1
  Cr  Cr47  1  0.827647  0.519620  0.381346  1
  Cr  Cr48  1  0.750187  0.774751  0.401850  1
  Cr  Cr49  1  0.137271  0.818088  0.403094  1
  Cr  Cr50  1  0.470205  0.486301  0.402419  1
  Cr  Cr51  1  0.772878  0.122619  0.382128  1
  Cr  Cr52  1  0.174386  0.173882  0.382963  1
  Cr  Cr53  1  0.075390  0.422690  0.400562  1
  Cr  Cr54  1  0.426510  0.095092  0.400502  1
  Cr  Cr55  1  0.119399  0.464665  0.450919  1
  Cr  Cr56  1  0.571538  0.252634  0.412224  1
  Cr  Cr57  1  0.514433  0.529959  0.452600  1
  Cr  Cr58  1  0.872519  0.564306  0.431855  1
  Cr  Cr59  1  0.218595  0.218371  0.432465  1
  Cr  Cr60  1  0.527905  0.875683  0.432006  1
  Cr  Cr61  1  0.904653  0.919626  0.412587  1
  Cr  Cr62  1  0.818482  0.164982  0.431486  1
  Cr  Cr63  1  0.182455  0.860752  0.453355  1
  Cr  Cr64  1  0.374925  0.721563  0.422063  1
  Cr  Cr65  1  0.725765  0.403690  0.422265  1
  Cr  Cr66  1  0.659598  0.677974  0.462090  1
  Cr  Cr67  1  0.030254  0.711950  0.443023  1
  Cr  Cr68  1  0.365794  0.377273  0.443010  1
  Cr  Cr69  1  0.669208  0.016371  0.421931  1
  Cr  Cr70  1  0.055891  0.071425  0.422660  1
  Cr  Cr71  1  0.970877  0.316689  0.440835  1
  Cr  Cr72  1  0.331679  0.007052  0.463389  1
  Cr  Cr73  1  0.014846  0.359686  0.490887  1
  Cr  Cr74  1  0.473746  0.137855  0.451673  1
  Cr  Cr75  1  0.410588  0.419927  0.492989  1
  Cr  Cr76  1  0.770865  0.447152  0.472386  1
  Cr  Cr77  1  0.100498  0.115698  0.472463  1
  Cr  Cr78  1  0.419207  0.765302  0.472223  1
  Cr  Cr79  1  0.792277  0.819850  0.452017  1
  Cr  Cr80  1  0.713909  0.059501  0.471204  1
  Cr  Cr81  1  0.074916  0.755425  0.493322  1
  Cr  Cr82  1  0.269858  0.615431  0.461833  1
  Cr  Cr83  1  0.617482  0.296674  0.462460  1
  Cr  Cr84  1  0.559131  0.573279  0.502637  1
  Cr  Cr85  1  0.916704  0.607877  0.482163  1
  Cr  Cr86  1  0.262831  0.261494  0.482376  1
  Cr  Cr87  1  0.572680  0.918597  0.482306  1
  Cr  Cr88  1  0.949967  0.962706  0.462556  1
  Cr  Cr89  1  0.862917  0.207871  0.481235  1
  Cr  Cr90  1  0.227408  0.904452  0.503361  1
  Cr  Cr91  1  0.907956  0.251092  0.531256  1
  Cr  Cr92  1  0.376500  0.050312  0.513001  1
  Cr  Cr93  1  0.307414  0.304540  0.532280  1
  Cr  Cr94  1  0.663287  0.340265  0.512812  1
  Cr  Cr95  1  -0.005029  0.006511  0.512590  1
  Cr  Cr96  1  0.314693  0.658946  0.511938  1
  Cr  Cr97  1  0.704481  0.721111  0.512162  1
  Cr  Cr98  1  0.617803  0.961576  0.532512  1
  Cr  Cr99  1  0.961739  0.651157  0.532273  1
  Cr  Cr100  1  0.164050  0.507745  0.501078  1
  Cr  Cr101  1  0.519970  0.181212  0.502119  1
  Cr  Cr102  1  0.455523  0.462992  0.542854  1
  Cr  Cr103  1  0.815675  0.490490  0.522627  1
  Cr  Cr104  1  0.145502  0.158770  0.522398  1
  Cr  Cr105  1  0.464205  0.808731  0.522531  1
  Cr  Cr106  1  0.836602  0.863772  0.501917  1
  Cr  Cr107  1  0.758618  0.102437  0.520830  1
  Cr  Cr108  1  0.120172  0.799142  0.543486  1
  Cr  Cr109  1  0.803350  0.145085  0.570283  1
  Cr  Cr110  1  0.272597  0.947459  0.553360  1
  Cr  Cr111  1  0.190498  0.201219  0.572367  1
  Cr  Cr112  1  0.565197  0.224692  0.552531  1
  Cr  Cr113  1  0.881620  0.906440  0.551825  1
  Cr  Cr114  1  0.209250  0.551130  0.551186  1
  Cr  Cr115  1  0.603727  0.616256  0.552696  1
  Cr  Cr116  1  0.509709  0.852007  0.573080  1
  Cr  Cr117  1  0.860811  0.533673  0.572771  1
  Cr  Cr118  1  0.059846  0.402748  0.540984  1
  Cr  Cr119  1  0.421115  0.092789  0.562535  1
  Cr  Cr120  1  0.352472  0.347028  0.582008  1
  Cr  Cr121  1  0.708773  0.383571  0.563407  1
  Cr  Cr122  1  0.040150  0.049840  0.562824  1
  Cr  Cr123  1  0.359576  0.702255  0.562165  1
  Cr  Cr124  1  0.749112  0.763586  0.562050  1
  Cr  Cr125  1  0.663786  0.004824  0.582631  1
  Cr  Cr126  1  0.007448  0.694525  0.582256  1
  Cr  Cr127  1  0.709586  0.046913  0.633130  1
  Cr  Cr128  1  0.165641  0.841929  0.593693  1
  Cr  Cr129  1  0.084258  0.094008  0.613277  1
  Cr  Cr130  1  0.468572  0.132727  0.611694  1
  Cr  Cr131  1  0.792348  0.806896  0.611420  1
  Cr  Cr132  1  0.106081  0.445439  0.591102  1
  Cr  Cr133  1  0.499403  0.505874  0.592610  1
  Cr  Cr134  1  0.404627  0.745282  0.612566  1
  Cr  Cr135  1  0.754523  0.426122  0.614191  1
  Cr  Cr136  1  0.953624  0.294812  0.581525  1
  Cr  Cr137  1  0.317379  0.990273  0.603451  1
  Cr  Cr138  1  0.240301  0.240934  0.622108  1
  Cr  Cr139  1  0.610236  0.268915  0.603398  1
  Cr  Cr140  1  0.927541  0.948023  0.601889  1
  Cr  Cr141  1  0.253826  0.593661  0.601455  1
  Cr  Cr142  1  0.647853  0.657707  0.602884  1
  Cr  Cr143  1  0.556352  0.893918  0.624111  1
  Cr  Cr144  1  0.906128  0.579409  0.622457  1
  Cr  Cr145  1  0.608948  0.933726  0.677051  1
  Cr  Cr146  1  0.053935  0.736339  0.632534  1
  Cr  Cr147  1  0.973612  0.988967  0.652387  1
  Cr  Cr148  1  0.369364  0.026969  0.653513  1
  Cr  Cr149  1  0.688003  0.699948  0.652983  1
  Cr  Cr150  1  0.003736  0.340359  0.632167  1
  Cr  Cr151  1  0.396743  0.388289  0.631543  1
  Cr  Cr152  1  0.292714  0.638122  0.651769  1
  Cr  Cr153  1  0.653385  0.315414  0.655975  1
  Cr  Cr154  1  0.846322  0.187105  0.618983  1
  Cr  Cr155  1  0.213244  0.884060  0.643630  1
  Cr  Cr156  1  0.137415  0.134341  0.663330  1
  Cr  Cr157  1  0.509294  0.175872  0.661123  1
  Cr  Cr158  1  0.839582  0.840246  0.660549  1
  Cr  Cr159  1  0.151827  0.484436  0.641871  1
  Cr  Cr160  1  0.539329  0.548304  0.642426  1
  Cr  Cr161  1  0.450752  0.780617  0.663241  1
  Cr  Cr162  1  0.801193  0.471746  0.664101  1
  Cr  Cr163  1  0.504371  0.819477  0.713155  1
  Cr  Cr164  1  0.960707  0.610743  0.672965  1
  Cr  Cr165  1  0.870580  0.879379  0.712002  1
  Cr  Cr166  1  0.250215  0.932364  0.694734  1
  Cr  Cr167  1  0.589239  0.553561  0.694497  1
  Cr  Cr168  1  0.895510  0.227046  0.665889  1
  Cr  Cr169  1  0.273917  0.288960  0.673362  1
  Cr  Cr170  1  0.184601  0.530071  0.694477  1
  Cr  Cr171  1  0.559830  0.244803  0.710701  1
  Cr  Cr172  1  0.756582  0.090253  0.683504  1
  Cr  Cr173  1  0.091056  0.790877  0.683904  1
  Cr  Cr174  1  -0.000743  0.070111  0.704910  1
  Cr  Cr175  1  0.399311  0.086253  0.704657  1
  Cr  Cr176  1  0.755285  0.687529  0.703889  1
  Cr  Cr177  1  0.025650  0.362752  0.689392  1
  Cr  Cr178  1  0.425470  0.436134  0.681564  1
  Cr  Cr179  1  0.338972  0.680079  0.702738  1
  Cr  Cr180  1  0.775667  0.328183  0.708875  1
