# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.39512560
_cell_length_b   17.94404083
_cell_length_c   46.22214622
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   79.89738821
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu324
_cell_volume   8488.16265748
_cell_formula_units_Z   324
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
  Cu  Cu1  1  0.754038  0.655560  0.318413  1
  Cu  Cu2  1  0.419642  0.488587  0.318230  1
  Cu  Cu3  1  0.539136  0.704583  0.294695  1
  Cu  Cu4  1  0.751832  0.156101  0.318364  1
  Cu  Cu5  1  0.879260  0.368553  0.294354  1
  Cu  Cu6  1  0.817922  0.512598  0.306423  1
  Cu  Cu7  1  0.275152  0.390598  0.272279  1
  Cu  Cu8  1  0.210012  0.533055  0.293788  1
  Cu  Cu9  1  0.146754  0.681329  0.305886  1
  Cu  Cu10  1  0.419410  0.989459  0.318415  1
  Cu  Cu11  1  0.537692  0.206131  0.294434  1
  Cu  Cu12  1  0.476690  0.349176  0.305743  1
  Cu  Cu13  1  0.878352  0.868642  0.294498  1
  Cu  Cu14  1  0.815834  0.013406  0.306312  1
  Cu  Cu15  1  0.085407  0.823746  0.323196  1
  Cu  Cu16  1  0.206441  0.037583  0.294472  1
  Cu  Cu17  1  0.145224  0.183762  0.305650  1
  Cu  Cu18  1  0.479801  0.847435  0.306173  1
  Cu  Cu19  1  0.587106  0.572182  0.318323  1
  Cu  Cu20  1  0.251352  0.406594  0.322694  1
  Cu  Cu21  1  0.372953  0.620450  0.294285  1
  Cu  Cu22  1  0.585729  0.072825  0.318200  1
  Cu  Cu23  1  0.706524  0.288316  0.294606  1
  Cu  Cu24  1  0.648974  0.430372  0.306331  1
  Cu  Cu25  1  0.105724  0.307129  0.272357  1
  Cu  Cu26  1  0.048417  0.448037  0.293926  1
  Cu  Cu27  1  0.983343  0.595938  0.306263  1
  Cu  Cu28  1  0.252574  0.905684  0.318463  1
  Cu  Cu29  1  0.371782  0.122450  0.294368  1
  Cu  Cu30  1  0.308338  0.268230  0.305406  1
  Cu  Cu31  1  0.708025  0.787185  0.294664  1
  Cu  Cu32  1  0.648624  0.930284  0.306436  1
  Cu  Cu33  1  0.095856  0.800834  0.274093  1
  Cu  Cu34  1  0.044018  0.949639  0.293900  1
  Cu  Cu35  1  0.980829  0.097339  0.306340  1
  Cu  Cu36  1  0.308412  0.765709  0.305317  1
  Cu  Cu37  1  0.645682  0.627110  0.367233  1
  Cu  Cu38  1  0.314269  0.461250  0.368732  1
  Cu  Cu39  1  0.433226  0.675805  0.342516  1
  Cu  Cu40  1  0.645594  0.127055  0.367170  1
  Cu  Cu41  1  0.768976  0.342579  0.343235  1
  Cu  Cu42  1  0.706615  0.484611  0.355332  1
  Cu  Cu43  1  0.084925  0.323524  0.322743  1
  Cu  Cu44  1  0.098992  0.509880  0.343707  1
  Cu  Cu45  1  0.040460  0.651693  0.355334  1
  Cu  Cu46  1  0.313778  0.960474  0.367237  1
  Cu  Cu47  1  0.433402  0.176447  0.342545  1
  Cu  Cu48  1  0.374661  0.316645  0.356085  1
  Cu  Cu49  1  0.769360  0.841913  0.343186  1
  Cu  Cu50  1  0.706058  0.984983  0.355244  1
  Cu  Cu51  1  0.979191  0.792909  0.368756  1
  Cu  Cu52  1  0.100544  0.008483  0.342946  1
  Cu  Cu53  1  0.040477  0.151611  0.355144  1
  Cu  Cu54  1  0.372611  0.817643  0.354935  1
  Cu  Cu55  1  0.479968  0.543793  0.367162  1
  Cu  Cu56  1  0.146415  0.377230  0.369748  1
  Cu  Cu57  1  0.266912  0.591466  0.342687  1
  Cu  Cu58  1  0.479278  0.043888  0.367159  1
  Cu  Cu59  1  0.600562  0.259831  0.342824  1
  Cu  Cu60  1  0.539758  0.401090  0.355092  1
  Cu  Cu61  1  0.919513  0.239503  0.318398  1
  Cu  Cu62  1  0.933685  0.426999  0.343954  1
  Cu  Cu63  1  0.872979  0.568523  0.355513  1
  Cu  Cu64  1  0.147502  0.877947  0.368946  1
  Cu  Cu65  1  0.266464  0.092817  0.342689  1
  Cu  Cu66  1  0.208666  0.233490  0.356103  1
  Cu  Cu67  1  0.600889  0.759066  0.343017  1
  Cu  Cu68  1  0.540791  0.900808  0.355077  1
  Cu  Cu69  1  0.921799  0.739186  0.318148  1
  Cu  Cu70  1  0.932371  0.927265  0.343818  1
  Cu  Cu71  1  0.873596  0.068519  0.355294  1
  Cu  Cu72  1  0.209038  0.732747  0.356126  1
  Cu  Cu73  1  0.541329  0.597454  0.416452  1
  Cu  Cu74  1  0.208095  0.431139  0.417363  1
  Cu  Cu75  1  0.329659  0.645459  0.392276  1
  Cu  Cu76  1  0.541388  0.097108  0.416445  1
  Cu  Cu77  1  0.662027  0.313153  0.392058  1
  Cu  Cu78  1  0.600782  0.455277  0.404186  1
  Cu  Cu79  1  0.978570  0.292741  0.368677  1
  Cu  Cu80  1  0.994854  0.480649  0.392879  1
  Cu  Cu81  1  0.934490  0.622431  0.404425  1
  Cu  Cu82  1  0.208213  0.931217  0.416865  1
  Cu  Cu83  1  0.329642  0.145845  0.392243  1
  Cu  Cu84  1  0.269118  0.287885  0.405136  1
  Cu  Cu85  1  0.662243  0.813077  0.392074  1
  Cu  Cu86  1  0.601074  0.955251  0.404127  1
  Cu  Cu87  1  0.873911  0.763969  0.416751  1
  Cu  Cu88  1  0.995016  0.980509  0.392517  1
  Cu  Cu89  1  0.935087  0.122253  0.404258  1
  Cu  Cu90  1  0.268690  0.788181  0.404698  1
  Cu  Cu91  1  0.374969  0.514376  0.416950  1
  Cu  Cu92  1  0.040649  0.347239  0.417247  1
  Cu  Cu93  1  0.161651  0.563618  0.392487  1
  Cu  Cu94  1  0.374523  0.014064  0.416390  1
  Cu  Cu95  1  0.496072  0.229130  0.392259  1
  Cu  Cu96  1  0.435102  0.371550  0.404675  1
  Cu  Cu97  1  0.812334  0.210040  0.367323  1
  Cu  Cu98  1  0.828613  0.396826  0.392533  1
  Cu  Cu99  1  0.767564  0.538812  0.404307  1
  Cu  Cu100  1  0.041038  0.847544  0.416984  1
  Cu  Cu101  1  0.162276  0.063099  0.391944  1
  Cu  Cu102  1  0.102207  0.204853  0.404732  1
  Cu  Cu103  1  0.494766  0.729762  0.391856  1
  Cu  Cu104  1  0.434397  0.871787  0.404038  1
  Cu  Cu105  1  0.812887  0.710130  0.367305  1
  Cu  Cu106  1  0.828403  0.896863  0.392409  1
  Cu  Cu107  1  0.767902  0.038834  0.404193  1
  Cu  Cu108  1  0.102264  0.704919  0.404861  1
  Cu  Cu109  1  0.436253  0.568019  0.465694  1
  Cu  Cu110  1  0.102397  0.401315  0.465794  1
  Cu  Cu111  1  0.223799  0.616972  0.441529  1
  Cu  Cu112  1  0.436130  0.067737  0.465465  1
  Cu  Cu113  1  0.557121  0.283401  0.441233  1
  Cu  Cu114  1  0.496334  0.425705  0.453506  1
  Cu  Cu115  1  0.873663  0.263837  0.416745  1
  Cu  Cu116  1  0.889882  0.450693  0.441465  1
  Cu  Cu117  1  0.829206  0.592690  0.453275  1
  Cu  Cu118  1  0.102592  0.901360  0.465618  1
  Cu  Cu119  1  0.223904  0.116748  0.441245  1
  Cu  Cu120  1  0.163336  0.258883  0.453716  1
  Cu  Cu121  1  0.556563  0.783758  0.440990  1
  Cu  Cu122  1  0.496125  0.925759  0.453166  1
  Cu  Cu123  1  0.768668  0.734693  0.465448  1
  Cu  Cu124  1  0.890065  0.950631  0.441293  1
  Cu  Cu125  1  0.829672  0.092506  0.453249  1
  Cu  Cu126  1  0.163325  0.759102  0.453633  1
  Cu  Cu127  1  0.269464  0.484709  0.465855  1
  Cu  Cu128  1  0.935381  0.317892  0.465656  1
  Cu  Cu129  1  0.056670  0.534172  0.441563  1
  Cu  Cu130  1  0.269369  0.984674  0.465557  1
  Cu  Cu131  1  0.390833  0.199835  0.441418  1
  Cu  Cu132  1  0.330097  0.342260  0.453762  1
  Cu  Cu133  1  0.707750  0.180543  0.416416  1
  Cu  Cu134  1  0.723175  0.367153  0.441186  1
  Cu  Cu135  1  0.662664  0.509122  0.453287  1
  Cu  Cu136  1  0.935602  0.817988  0.465579  1
  Cu  Cu137  1  0.056913  0.034019  0.441236  1
  Cu  Cu138  1  -0.003600  0.175795  0.453425  1
  Cu  Cu139  1  0.390427  0.700115  0.441222  1
  Cu  Cu140  1  0.329825  0.842429  0.453404  1
  Cu  Cu141  1  0.707094  0.680893  0.416321  1
  Cu  Cu142  1  0.723302  0.867186  0.441162  1
  Cu  Cu143  1  0.663042  0.009045  0.453252  1
  Cu  Cu144  1  0.996238  0.675897  0.453533  1
  Cu  Cu145  1  0.330937  0.538456  0.514602  1
  Cu  Cu146  1  -0.002943  0.371833  0.514474  1
  Cu  Cu147  1  0.118402  0.587715  0.490414  1
  Cu  Cu148  1  0.330842  0.038383  0.514390  1
  Cu  Cu149  1  0.452101  0.254008  0.490323  1
  Cu  Cu150  1  0.391449  0.396262  0.502535  1
  Cu  Cu151  1  0.769038  0.234490  0.465547  1
  Cu  Cu152  1  0.784729  0.420988  0.490219  1
  Cu  Cu153  1  0.724270  0.563060  0.502284  1
  Cu  Cu154  1  -0.002720  0.871801  0.514446  1
  Cu  Cu155  1  0.118415  0.087581  0.490200  1
  Cu  Cu156  1  0.057767  0.229623  0.502367  1
  Cu  Cu157  1  0.451823  0.754207  0.490159  1
  Cu  Cu158  1  0.391287  0.896302  0.502282  1
  Cu  Cu159  1  0.663919  0.705216  0.514463  1
  Cu  Cu160  1  0.784977  0.920949  0.490178  1
  Cu  Cu161  1  0.724701  0.062919  0.502303  1
  Cu  Cu162  1  0.057787  0.729718  0.502395  1
  Cu  Cu163  1  0.163972  0.455127  0.514543  1
  Cu  Cu164  1  0.830473  0.288476  0.514527  1
  Cu  Cu165  1  0.951444  0.504457  0.490304  1
  Cu  Cu166  1  0.164047  0.955065  0.514424  1
  Cu  Cu167  1  0.285367  0.170688  0.490293  1
  Cu  Cu168  1  0.224672  0.312901  0.502497  1
  Cu  Cu169  1  0.602866  0.151056  0.465512  1
  Cu  Cu170  1  0.618421  0.337484  0.490227  1
  Cu  Cu171  1  0.557920  0.479639  0.502439  1
  Cu  Cu172  1  0.830434  0.788553  0.514428  1
  Cu  Cu173  1  0.951676  1.004310  0.490179  1
  Cu  Cu174  1  0.891098  0.146290  0.502299  1
  Cu  Cu175  1  0.285303  0.670884  0.490358  1
  Cu  Cu176  1  0.224704  0.812983  0.502395  1
  Cu  Cu177  1  0.602510  0.651389  0.465463  1
  Cu  Cu178  1  0.618208  0.837658  0.490079  1
  Cu  Cu179  1  0.557920  0.979615  0.502254  1
  Cu  Cu180  1  0.890843  0.646426  0.502283  1
  Cu  Cu181  1  0.225598  0.508934  0.563356  1
  Cu  Cu182  1  0.891912  0.342477  0.563455  1
  Cu  Cu183  1  0.013058  0.558203  0.539167  1
  Cu  Cu184  1  0.225549  0.008913  0.563201  1
  Cu  Cu185  1  0.346927  0.224715  0.539200  1
  Cu  Cu186  1  0.286201  0.366778  0.551305  1
  Cu  Cu187  1  0.664235  0.205005  0.514549  1
  Cu  Cu188  1  0.679899  0.391438  0.539231  1
  Cu  Cu189  1  0.619578  0.533508  0.551431  1
  Cu  Cu190  1  0.892084  0.842446  0.563395  1
  Cu  Cu191  1  0.013099  0.058061  0.539081  1
  Cu  Cu192  1  0.952516  0.200199  0.551219  1
  Cu  Cu193  1  0.346904  0.724732  0.539222  1
  Cu  Cu194  1  0.286107  0.866724  0.551205  1
  Cu  Cu195  1  0.559235  0.675592  0.563544  1
  Cu  Cu196  1  0.679906  0.891488  0.539137  1
  Cu  Cu197  1  0.619666  0.033470  0.551285  1
  Cu  Cu198  1  0.952444  0.700283  0.551186  1
  Cu  Cu199  1  0.058660  0.425670  0.563297  1
  Cu  Cu200  1  0.725759  0.258925  0.563567  1
  Cu  Cu201  1  0.846280  0.474811  0.539152  1
  Cu  Cu202  1  0.058870  0.925628  0.563354  1
  Cu  Cu203  1  0.179869  0.141410  0.539091  1
  Cu  Cu204  1  0.119159  0.283520  0.551182  1
  Cu  Cu205  1  0.497671  0.121632  0.514443  1
  Cu  Cu206  1  0.513633  0.308017  0.539262  1
  Cu  Cu207  1  0.452977  0.450132  0.551420  1
  Cu  Cu208  1  0.725447  0.759098  0.563433  1
  Cu  Cu209  1  0.846605  0.974755  0.539157  1
  Cu  Cu210  1  0.786241  0.116784  0.551350  1
  Cu  Cu211  1  0.180002  0.641501  0.539227  1
  Cu  Cu212  1  0.119300  0.783475  0.551228  1
  Cu  Cu213  1  0.497629  0.621814  0.514572  1
  Cu  Cu214  1  0.513362  0.808098  0.539128  1
  Cu  Cu215  1  0.452884  0.950143  0.551180  1
  Cu  Cu216  1  0.785869  0.616912  0.551250  1
  Cu  Cu217  1  0.120446  0.479455  0.612093  1
  Cu  Cu218  1  0.787465  0.312656  0.612670  1
  Cu  Cu219  1  0.907851  0.528640  0.588007  1
  Cu  Cu220  1  0.120672  0.979592  0.612171  1
  Cu  Cu221  1  0.241538  0.195435  0.587903  1
  Cu  Cu222  1  0.180717  0.337299  0.599961  1
  Cu  Cu223  1  0.559257  0.175475  0.563445  1
  Cu  Cu224  1  0.575547  0.361917  0.588263  1
  Cu  Cu225  1  0.514493  0.503984  0.600379  1
  Cu  Cu226  1  0.786894  0.813195  0.612392  1
  Cu  Cu227  1  0.908172  0.028591  0.588128  1
  Cu  Cu228  1  0.847758  0.170693  0.600363  1
  Cu  Cu229  1  0.241662  0.695343  0.588075  1
  Cu  Cu230  1  0.180841  0.837129  0.600053  1
  Cu  Cu231  1  0.454099  0.646041  0.612379  1
  Cu  Cu232  1  0.575053  0.862025  0.588125  1
  Cu  Cu233  1  0.514432  1.003975  0.600084  1
  Cu  Cu234  1  0.847238  0.670915  0.600129  1
  Cu  Cu235  1  0.953736  0.396451  0.612331  1
  Cu  Cu236  1  0.620937  0.229194  0.612513  1
  Cu  Cu237  1  0.741533  0.445300  0.588292  1
  Cu  Cu238  1  0.953985  0.896382  0.612397  1
  Cu  Cu239  1  0.074577  0.111964  0.587861  1
  Cu  Cu240  1  0.013737  0.254200  0.600045  1
  Cu  Cu241  1  0.392362  0.092219  0.563230  1
  Cu  Cu242  1  0.408793  0.278677  0.588115  1
  Cu  Cu243  1  0.347953  0.420577  0.600169  1
  Cu  Cu244  1  0.621018  0.729282  0.612588  1
  Cu  Cu245  1  0.741728  0.945402  0.588209  1
  Cu  Cu246  1  0.681392  0.087220  0.600385  1
  Cu  Cu247  1  0.074705  0.612070  0.587962  1
  Cu  Cu248  1  0.013850  0.754165  0.600075  1
  Cu  Cu249  1  0.392470  0.592258  0.563461  1
  Cu  Cu250  1  0.408656  0.778547  0.588134  1
  Cu  Cu251  1  0.347687  0.920480  0.599938  1
  Cu  Cu252  1  0.681332  0.587293  0.600477  1
  Cu  Cu253  1  0.017336  0.450016  0.661286  1
  Cu  Cu254  1  0.682635  0.283257  0.661580  1
  Cu  Cu255  1  0.803886  0.499225  0.637401  1
  Cu  Cu256  1  0.017950  0.950158  0.661277  1
  Cu  Cu257  1  0.136076  0.166246  0.636471  1
  Cu  Cu258  1  0.075559  0.307891  0.648798  1
  Cu  Cu259  1  0.453923  0.146060  0.612100  1
  Cu  Cu260  1  0.471059  0.332519  0.637092  1
  Cu  Cu261  1  0.408602  0.474522  0.649175  1
  Cu  Cu262  1  0.681579  0.784165  0.661563  1
  Cu  Cu263  1  0.803905  0.999403  0.637412  1
  Cu  Cu264  1  0.743001  0.140629  0.649510  1
  Cu  Cu265  1  0.136197  0.666165  0.636774  1
  Cu  Cu266  1  0.075534  0.807729  0.648995  1
  Cu  Cu267  1  0.348603  0.616396  0.661131  1
  Cu  Cu268  1  0.470506  0.832430  0.637001  1
  Cu  Cu269  1  0.408603  0.974219  0.648618  1
  Cu  Cu270  1  0.743194  0.640855  0.649617  1
  Cu  Cu271  1  0.849768  0.366670  0.661393  1
  Cu  Cu272  1  0.515705  0.199592  0.661161  1
  Cu  Cu273  1  0.636960  0.415977  0.637353  1
  Cu  Cu274  1  0.849130  0.867456  0.661342  1
  Cu  Cu275  1  0.970171  0.082777  0.636961  1
  Cu  Cu276  1  0.910054  0.223801  0.649579  1
  Cu  Cu277  1  0.287024  0.062834  0.611908  1
  Cu  Cu278  1  0.303816  0.249374  0.636748  1
  Cu  Cu279  1  0.243150  0.390681  0.648678  1
  Cu  Cu280  1  0.515923  0.699699  0.661433  1
  Cu  Cu281  1  0.636692  0.916189  0.637194  1
  Cu  Cu282  1  0.575061  0.057801  0.649102  1
  Cu  Cu283  1  0.969160  0.582832  0.636614  1
  Cu  Cu284  1  0.908056  0.725153  0.649011  1
  Cu  Cu285  1  0.287138  0.562810  0.612192  1
  Cu  Cu286  1  0.303639  0.748996  0.637004  1
  Cu  Cu287  1  0.242998  0.890563  0.648625  1
  Cu  Cu288  1  0.575777  0.557764  0.649337  1
  Cu  Cu289  1  0.914526  0.422443  0.709226  1
  Cu  Cu290  1  0.577052  0.253397  0.709612  1
  Cu  Cu291  1  0.699681  0.470284  0.686043  1
  Cu  Cu292  1  0.913483  0.923214  0.709044  1
  Cu  Cu293  1  0.038331  0.135384  0.686240  1
  Cu  Cu294  1  0.970957  0.277884  0.698020  1
  Cu  Cu295  1  0.347738  0.116910  0.660565  1
  Cu  Cu296  1  0.365784  0.303410  0.685659  1
  Cu  Cu297  1  0.296914  0.446273  0.697469  1
  Cu  Cu298  1  0.576128  0.755034  0.709799  1
  Cu  Cu299  1  0.697242  0.971243  0.686033  1
  Cu  Cu300  1  0.637492  0.110534  0.697953  1
  Cu  Cu301  1  0.031008  0.637385  0.685230  1
  Cu  Cu302  1  0.969661  0.778542  0.697964  1
  Cu  Cu303  1  0.239254  0.586291  0.708945  1
  Cu  Cu304  1  0.364945  0.803629  0.685693  1
  Cu  Cu305  1  0.295471  0.946575  0.697166  1
  Cu  Cu306  1  0.638534  0.610790  0.698129  1
  Cu  Cu307  1  0.744266  0.338557  0.709715  1
  Cu  Cu308  1  0.407426  0.169465  0.708776  1
  Cu  Cu309  1  0.530288  0.387259  0.686109  1
  Cu  Cu310  1  0.743077  0.839902  0.709656  1
  Cu  Cu311  1  0.870989  0.053125  0.686225  1
  Cu  Cu312  1  0.805931  0.193924  0.698058  1
  Cu  Cu313  1  0.182547  0.033957  0.660926  1
  Cu  Cu314  1  0.198812  0.220199  0.685103  1
  Cu  Cu315  1  0.137733  0.360319  0.697518  1
  Cu  Cu316  1  0.409238  0.670204  0.709604  1
  Cu  Cu317  1  0.528548  0.888280  0.686002  1
  Cu  Cu318  1  0.462717  0.029389  0.697409  1
  Cu  Cu319  1  0.870569  0.552633  0.686360  1
  Cu  Cu320  1  0.803282  0.695322  0.698113  1
  Cu  Cu321  1  0.180884  0.533774  0.660740  1
  Cu  Cu322  1  0.198366  0.719676  0.685631  1
  Cu  Cu323  1  0.137199  0.860314  0.697646  1
  Cu  Cu324  1  0.469189  0.527780  0.698054  1
