# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.04416580
_cell_length_b   17.34799385
_cell_length_c   46.69422712
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   76.38724702
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu336
_cell_volume   8695.02451109
_cell_formula_units_Z   336
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  0.088106  0.359006  0.285219  1
  Cu  Cu2  1  0.483533  0.366285  0.275294  1
  Cu  Cu3  1  0.697426  0.353904  0.294598  1
  Cu  Cu4  1  0.088106  0.859006  0.285219  1
  Cu  Cu5  1  0.483533  0.866285  0.275294  1
  Cu  Cu6  1  0.697426  0.853904  0.294598  1
  Cu  Cu7  1  0.303494  0.482762  0.285728  1
  Cu  Cu8  1  0.693001  0.490347  0.275986  1
  Cu  Cu9  1  0.909680  0.477663  0.295196  1
  Cu  Cu10  1  0.303494  0.982762  0.285728  1
  Cu  Cu11  1  0.693001  0.990347  0.275986  1
  Cu  Cu12  1  0.909680  0.977663  0.295196  1
  Cu  Cu13  1  1.000393  0.599638  0.299312  1
  Cu  Cu14  1  0.393177  0.605350  0.289800  1
  Cu  Cu15  1  0.781101  0.613001  0.279821  1
  Cu  Cu16  1  1.000393  0.099638  0.299312  1
  Cu  Cu17  1  0.393177  0.105350  0.289800  1
  Cu  Cu18  1  0.781101  0.113001  0.279821  1
  Cu  Cu19  1  0.090128  0.722661  0.303579  1
  Cu  Cu20  1  0.482768  0.728889  0.293301  1
  Cu  Cu21  1  0.872469  0.734443  0.283830  1
  Cu  Cu22  1  0.090128  0.222661  0.303579  1
  Cu  Cu23  1  0.482768  0.228889  0.293301  1
  Cu  Cu24  1  0.872469  0.234443  0.283830  1
  Cu  Cu25  1  0.910309  0.342867  0.315676  1
  Cu  Cu26  1  0.303202  0.346758  0.304912  1
  Cu  Cu27  1  0.517337  0.337707  0.327070  1
  Cu  Cu28  1  0.910309  0.842867  0.315676  1
  Cu  Cu29  1  0.303202  0.846758  0.304912  1
  Cu  Cu30  1  0.517337  0.837707  0.327070  1
  Cu  Cu31  1  0.124910  0.466920  0.316823  1
  Cu  Cu32  1  0.517488  0.473393  0.306924  1
  Cu  Cu33  1  0.733104  0.462298  0.328006  1
  Cu  Cu34  1  0.124910  0.966920  0.316823  1
  Cu  Cu35  1  0.517488  0.973393  0.306924  1
  Cu  Cu36  1  0.733104  0.962298  0.328006  1
  Cu  Cu37  1  0.821525  0.584853  0.331758  1
  Cu  Cu38  1  0.213841  0.589886  0.321082  1
  Cu  Cu39  1  0.605165  0.596426  0.311137  1
  Cu  Cu40  1  0.821525  0.084853  0.331758  1
  Cu  Cu41  1  0.213841  0.089886  0.321082  1
  Cu  Cu42  1  0.605165  0.096426  0.311137  1
  Cu  Cu43  1  0.910325  0.707077  0.335906  1
  Cu  Cu44  1  0.302742  0.713124  0.324938  1
  Cu  Cu45  1  0.693689  0.719816  0.314811  1
  Cu  Cu46  1  0.910325  0.207077  0.335906  1
  Cu  Cu47  1  0.302742  0.213124  0.324938  1
  Cu  Cu48  1  0.693689  0.219816  0.314811  1
  Cu  Cu49  1  0.732470  0.326817  0.347947  1
  Cu  Cu50  1  0.124606  0.331524  0.337485  1
  Cu  Cu51  1  0.338555  0.321224  0.358657  1
  Cu  Cu52  1  0.732470  0.826817  0.347947  1
  Cu  Cu53  1  0.124606  0.831524  0.337485  1
  Cu  Cu54  1  0.338555  0.821224  0.358657  1
  Cu  Cu55  1  0.947522  0.451019  0.348776  1
  Cu  Cu56  1  0.339569  0.455996  0.338275  1
  Cu  Cu57  1  0.554599  0.446048  0.360009  1
  Cu  Cu58  1  0.947522  0.951019  0.348776  1
  Cu  Cu59  1  0.339569  0.955996  0.338275  1
  Cu  Cu60  1  0.554599  0.946048  0.360009  1
  Cu  Cu61  1  0.642331  0.568983  0.364251  1
  Cu  Cu62  1  0.035445  0.573902  0.353076  1
  Cu  Cu63  1  0.426991  0.579647  0.342908  1
  Cu  Cu64  1  0.642331  0.068983  0.364251  1
  Cu  Cu65  1  0.035445  0.073902  0.353076  1
  Cu  Cu66  1  0.426991  0.079647  0.342908  1
  Cu  Cu67  1  0.730731  0.691615  0.368237  1
  Cu  Cu68  1  0.123905  0.696654  0.357359  1
  Cu  Cu69  1  0.515405  0.702655  0.346960  1
  Cu  Cu70  1  0.730731  0.191615  0.368237  1
  Cu  Cu71  1  0.123905  0.196654  0.357359  1
  Cu  Cu72  1  0.515405  0.202655  0.346960  1
  Cu  Cu73  1  0.553640  0.310589  0.380400  1
  Cu  Cu74  1  0.946298  0.315747  0.369358  1
  Cu  Cu75  1  0.160509  0.305081  0.391084  1
  Cu  Cu76  1  0.553640  0.810589  0.380400  1
  Cu  Cu77  1  0.946298  0.815747  0.369358  1
  Cu  Cu78  1  0.160509  0.805081  0.391084  1
  Cu  Cu79  1  0.769361  0.435020  0.381445  1
  Cu  Cu80  1  0.161467  0.440372  0.370457  1
  Cu  Cu81  1  0.376071  0.429665  0.392083  1
  Cu  Cu82  1  0.769361  0.935020  0.381445  1
  Cu  Cu83  1  0.161467  0.940372  0.370457  1
  Cu  Cu84  1  0.376071  0.929665  0.392083  1
  Cu  Cu85  1  0.463855  0.552703  0.396560  1
  Cu  Cu86  1  0.857197  0.557836  0.385528  1
  Cu  Cu87  1  0.249315  0.563153  0.374816  1
  Cu  Cu88  1  0.463855  0.052703  0.396560  1
  Cu  Cu89  1  0.857197  0.057836  0.385528  1
  Cu  Cu90  1  0.249315  0.063153  0.374816  1
  Cu  Cu91  1  0.552129  0.675492  0.400778  1
  Cu  Cu92  1  0.945329  0.680648  0.389812  1
  Cu  Cu93  1  0.337334  0.686302  0.379100  1
  Cu  Cu94  1  0.552129  0.175492  0.400778  1
  Cu  Cu95  1  0.945329  0.180648  0.389812  1
  Cu  Cu96  1  0.337334  0.186302  0.379100  1
  Cu  Cu97  1  0.375014  0.294492  0.412585  1
  Cu  Cu98  1  0.768050  0.299769  0.401818  1
  Cu  Cu99  1  0.982261  0.289043  0.423344  1
  Cu  Cu100  1  0.375014  0.794492  0.412585  1
  Cu  Cu101  1  0.768050  0.799769  0.401818  1
  Cu  Cu102  1  0.982261  0.789043  0.423344  1
  Cu  Cu103  1  0.590728  0.419007  0.413740  1
  Cu  Cu104  1  0.983492  0.424211  0.402802  1
  Cu  Cu105  1  0.197812  0.413595  0.424396  1
  Cu  Cu106  1  0.590728  0.919007  0.413740  1
  Cu  Cu107  1  0.983492  0.924211  0.402802  1
  Cu  Cu108  1  0.197812  0.913595  0.424396  1
  Cu  Cu109  1  0.285734  0.536445  0.428763  1
  Cu  Cu110  1  0.678710  0.541837  0.418017  1
  Cu  Cu111  1  0.071341  0.547122  0.407124  1
  Cu  Cu112  1  0.285734  0.036445  0.428763  1
  Cu  Cu113  1  0.678710  0.041837  0.418017  1
  Cu  Cu114  1  0.071341  0.047122  0.407124  1
  Cu  Cu115  1  0.373805  0.659376  0.433105  1
  Cu  Cu116  1  0.766832  0.664619  0.422217  1
  Cu  Cu117  1  0.159462  0.669948  0.411463  1
  Cu  Cu118  1  0.373805  0.159376  0.433105  1
  Cu  Cu119  1  0.766832  0.164619  0.422217  1
  Cu  Cu120  1  0.159462  0.169948  0.411463  1
  Cu  Cu121  1  0.196711  0.278372  0.444936  1
  Cu  Cu122  1  0.589624  0.283740  0.434205  1
  Cu  Cu123  1  0.804041  0.272958  0.455722  1
  Cu  Cu124  1  0.196711  0.778372  0.444936  1
  Cu  Cu125  1  0.589624  0.783740  0.434205  1
  Cu  Cu126  1  0.804041  0.772958  0.455722  1
  Cu  Cu127  1  0.412318  0.402885  0.445979  1
  Cu  Cu128  1  0.805234  0.408169  0.435253  1
  Cu  Cu129  1  0.019607  0.397465  0.456746  1
  Cu  Cu130  1  0.412318  0.902885  0.445979  1
  Cu  Cu131  1  0.805234  0.908169  0.435253  1
  Cu  Cu132  1  0.019607  0.897465  0.456746  1
  Cu  Cu133  1  0.107555  0.520346  0.461072  1
  Cu  Cu134  1  0.500315  0.525766  0.450369  1
  Cu  Cu135  1  0.893185  0.531030  0.439487  1
  Cu  Cu136  1  0.107555  0.020346  0.461072  1
  Cu  Cu137  1  0.500315  0.025766  0.450369  1
  Cu  Cu138  1  0.893185  0.031030  0.439487  1
  Cu  Cu139  1  0.195617  0.643190  0.465424  1
  Cu  Cu140  1  0.588461  0.648568  0.454660  1
  Cu  Cu141  1  0.981208  0.653887  0.443815  1
  Cu  Cu142  1  0.195617  0.143190  0.465424  1
  Cu  Cu143  1  0.588461  0.148568  0.454660  1
  Cu  Cu144  1  0.981208  0.153887  0.443815  1
  Cu  Cu145  1  0.018461  0.262268  0.477270  1
  Cu  Cu146  1  0.411245  0.267681  0.466498  1
  Cu  Cu147  1  0.625770  0.256919  0.488079  1
  Cu  Cu148  1  0.018461  0.762268  0.477270  1
  Cu  Cu149  1  0.411245  0.767681  0.466498  1
  Cu  Cu150  1  0.625770  0.756919  0.488079  1
  Cu  Cu151  1  0.234036  0.386785  0.478309  1
  Cu  Cu152  1  0.626855  0.392140  0.467579  1
  Cu  Cu153  1  0.841356  0.381361  0.489121  1
  Cu  Cu154  1  0.234036  0.886785  0.478309  1
  Cu  Cu155  1  0.626855  0.892140  0.467579  1
  Cu  Cu156  1  0.841356  0.881361  0.489121  1
  Cu  Cu157  1  0.929374  0.504226  0.493422  1
  Cu  Cu158  1  0.322057  0.509633  0.482656  1
  Cu  Cu159  1  0.714910  0.514969  0.471887  1
  Cu  Cu160  1  0.929374  0.004226  0.493422  1
  Cu  Cu161  1  0.322057  0.009633  0.482656  1
  Cu  Cu162  1  0.714910  0.014969  0.471887  1
  Cu  Cu163  1  0.017385  0.627090  0.497759  1
  Cu  Cu164  1  0.410133  0.632496  0.487012  1
  Cu  Cu165  1  0.802965  0.637791  0.476184  1
  Cu  Cu166  1  0.017385  0.127090  0.497759  1
  Cu  Cu167  1  0.410133  0.132496  0.487012  1
  Cu  Cu168  1  0.802965  0.137791  0.476184  1
  Cu  Cu169  1  0.840238  0.246157  0.509635  1
  Cu  Cu170  1  0.232944  0.251573  0.498830  1
  Cu  Cu171  1  0.447481  0.240854  0.520406  1
  Cu  Cu172  1  0.840238  0.746157  0.509635  1
  Cu  Cu173  1  0.232944  0.751573  0.498830  1
  Cu  Cu174  1  0.447481  0.740854  0.520406  1
  Cu  Cu175  1  0.055802  0.370651  0.510673  1
  Cu  Cu176  1  0.448541  0.376057  0.499879  1
  Cu  Cu177  1  0.663038  0.365325  0.521462  1
  Cu  Cu178  1  0.055802  0.870651  0.510673  1
  Cu  Cu179  1  0.448541  0.876057  0.499879  1
  Cu  Cu180  1  0.663038  0.865325  0.521462  1
  Cu  Cu181  1  0.751139  0.488140  0.525774  1
  Cu  Cu182  1  0.143819  0.493525  0.514981  1
  Cu  Cu183  1  0.536598  0.498916  0.504234  1
  Cu  Cu184  1  0.751139  0.988140  0.525774  1
  Cu  Cu185  1  0.143819  0.993525  0.514981  1
  Cu  Cu186  1  0.536598  0.998916  0.504234  1
  Cu  Cu187  1  0.839178  0.610977  0.530122  1
  Cu  Cu188  1  0.231861  0.616374  0.519328  1
  Cu  Cu189  1  0.624689  0.621734  0.508560  1
  Cu  Cu190  1  0.839178  0.110977  0.530122  1
  Cu  Cu191  1  0.231861  0.116374  0.519328  1
  Cu  Cu192  1  0.624689  0.121734  0.508560  1
  Cu  Cu193  1  0.661990  0.230129  0.541975  1
  Cu  Cu194  1  0.054678  0.235455  0.531201  1
  Cu  Cu195  1  0.269160  0.224757  0.552724  1
  Cu  Cu196  1  0.661990  0.730129  0.541975  1
  Cu  Cu197  1  0.054678  0.735455  0.531201  1
  Cu  Cu198  1  0.269160  0.724757  0.552724  1
  Cu  Cu199  1  0.877541  0.354524  0.543019  1
  Cu  Cu200  1  0.270267  0.359949  0.532218  1
  Cu  Cu201  1  0.484745  0.349239  0.553788  1
  Cu  Cu202  1  0.877541  0.854524  0.543019  1
  Cu  Cu203  1  0.270267  0.859949  0.532218  1
  Cu  Cu204  1  0.484745  0.849239  0.553788  1
  Cu  Cu205  1  0.572826  0.472133  0.558120  1
  Cu  Cu206  1  0.965619  0.477398  0.547339  1
  Cu  Cu207  1  0.358346  0.482807  0.536540  1
  Cu  Cu208  1  0.572826  0.972133  0.558120  1
  Cu  Cu209  1  0.965619  0.977398  0.547339  1
  Cu  Cu210  1  0.358346  0.982807  0.536540  1
  Cu  Cu211  1  0.660921  0.594943  0.562444  1
  Cu  Cu212  1  0.053589  0.600278  0.551663  1
  Cu  Cu213  1  0.446384  0.605680  0.540910  1
  Cu  Cu214  1  0.660921  0.094943  0.562444  1
  Cu  Cu215  1  0.053589  0.100278  0.551663  1
  Cu  Cu216  1  0.446384  0.105680  0.540910  1
  Cu  Cu217  1  0.483750  0.214061  0.574324  1
  Cu  Cu218  1  0.876422  0.219310  0.563580  1
  Cu  Cu219  1  0.090831  0.208632  0.585154  1
  Cu  Cu220  1  0.483750  0.714061  0.574324  1
  Cu  Cu221  1  0.876422  0.719310  0.563580  1
  Cu  Cu222  1  0.090831  0.708632  0.585154  1
  Cu  Cu223  1  0.699128  0.338548  0.575375  1
  Cu  Cu224  1  0.092067  0.343791  0.564614  1
  Cu  Cu225  1  0.306482  0.333098  0.586143  1
  Cu  Cu226  1  0.699128  0.838548  0.575375  1
  Cu  Cu227  1  0.092067  0.843791  0.564614  1
  Cu  Cu228  1  0.306482  0.833098  0.586143  1
  Cu  Cu229  1  0.394651  0.456003  0.590424  1
  Cu  Cu230  1  0.787354  0.461298  0.579651  1
  Cu  Cu231  1  0.180126  0.466685  0.568865  1
  Cu  Cu232  1  0.394651  0.956003  0.590424  1
  Cu  Cu233  1  0.787354  0.961298  0.579651  1
  Cu  Cu234  1  0.180126  0.966685  0.568865  1
  Cu  Cu235  1  0.482604  0.578975  0.594815  1
  Cu  Cu236  1  0.875381  0.584156  0.584062  1
  Cu  Cu237  1  0.268085  0.589563  0.573204  1
  Cu  Cu238  1  0.482604  0.078975  0.594815  1
  Cu  Cu239  1  0.875381  0.084156  0.584062  1
  Cu  Cu240  1  0.268085  0.089563  0.573204  1
  Cu  Cu241  1  0.305341  0.198004  0.606576  1
  Cu  Cu242  1  0.698109  0.203364  0.595893  1
  Cu  Cu243  1  0.912514  0.192387  0.617621  1
  Cu  Cu244  1  0.305341  0.698004  0.606576  1
  Cu  Cu245  1  0.698109  0.703364  0.595893  1
  Cu  Cu246  1  0.912514  0.692387  0.617621  1
  Cu  Cu247  1  0.520659  0.322477  0.607744  1
  Cu  Cu248  1  0.913804  0.327592  0.596903  1
  Cu  Cu249  1  0.128489  0.316879  0.618638  1
  Cu  Cu250  1  0.520659  0.822477  0.607744  1
  Cu  Cu251  1  0.913804  0.827592  0.596903  1
  Cu  Cu252  1  0.128489  0.816879  0.618638  1
  Cu  Cu253  1  0.216703  0.439730  0.622716  1
  Cu  Cu254  1  0.608821  0.445437  0.612029  1
  Cu  Cu255  1  1.001959  0.450538  0.601231  1
  Cu  Cu256  1  0.216703  0.939730  0.622716  1
  Cu  Cu257  1  0.608821  0.945437  0.612029  1
  Cu  Cu258  1  1.001959  0.950538  0.601231  1
  Cu  Cu259  1  0.304486  0.562730  0.627031  1
  Cu  Cu260  1  0.697017  0.568185  0.616276  1
  Cu  Cu261  1  0.089740  0.573458  0.605512  1
  Cu  Cu262  1  0.304486  0.062730  0.627031  1
  Cu  Cu263  1  0.697017  0.068185  0.616276  1
  Cu  Cu264  1  0.089740  0.073458  0.605512  1
  Cu  Cu265  1  0.127105  0.181699  0.639091  1
  Cu  Cu266  1  0.519927  0.187332  0.628332  1
  Cu  Cu267  1  0.733970  0.176521  0.649805  1
  Cu  Cu268  1  0.127105  0.681699  0.639091  1
  Cu  Cu269  1  0.519927  0.687332  0.628332  1
  Cu  Cu270  1  0.733970  0.676521  0.649805  1
  Cu  Cu271  1  0.342335  0.306169  0.640177  1
  Cu  Cu272  1  0.735035  0.311747  0.629267  1
  Cu  Cu273  1  0.950468  0.300590  0.650653  1
  Cu  Cu274  1  0.342335  0.806169  0.640177  1
  Cu  Cu275  1  0.735035  0.811747  0.629267  1
  Cu  Cu276  1  0.950468  0.800590  0.650653  1
  Cu  Cu277  1  0.038525  0.423912  0.654980  1
  Cu  Cu278  1  0.430690  0.429193  0.644400  1
  Cu  Cu279  1  0.823642  0.434267  0.633439  1
  Cu  Cu280  1  0.038525  0.923912  0.654980  1
  Cu  Cu281  1  0.430690  0.929193  0.644400  1
  Cu  Cu282  1  0.823642  0.934267  0.633439  1
  Cu  Cu283  1  0.126603  0.546602  0.659009  1
  Cu  Cu284  1  0.518571  0.552284  0.648763  1
  Cu  Cu285  1  0.911635  0.557270  0.638040  1
  Cu  Cu286  1  0.126603  0.046602  0.659009  1
  Cu  Cu287  1  0.518571  0.052284  0.648763  1
  Cu  Cu288  1  0.911635  0.057270  0.638040  1
  Cu  Cu289  1  0.949455  0.165137  0.671451  1
  Cu  Cu290  1  0.341200  0.171378  0.660153  1
  Cu  Cu291  1  0.556655  0.159959  0.682077  1
  Cu  Cu292  1  0.949455  0.665137  0.671451  1
  Cu  Cu293  1  0.341200  0.671378  0.660153  1
  Cu  Cu294  1  0.556655  0.659959  0.682077  1
  Cu  Cu295  1  0.163619  0.289470  0.672616  1
  Cu  Cu296  1  0.555513  0.296086  0.661640  1
  Cu  Cu297  1  0.771483  0.284349  0.682427  1
  Cu  Cu298  1  0.163619  0.789470  0.672616  1
  Cu  Cu299  1  0.555513  0.796086  0.661640  1
  Cu  Cu300  1  0.771483  0.784349  0.682427  1
  Cu  Cu301  1  0.860931  0.407485  0.686589  1
  Cu  Cu302  1  0.252568  0.412569  0.676267  1
  Cu  Cu303  1  0.644262  0.418722  0.665785  1
  Cu  Cu304  1  0.860931  0.907485  0.686589  1
  Cu  Cu305  1  0.252568  0.912569  0.676267  1
  Cu  Cu306  1  0.644262  0.918722  0.665785  1
  Cu  Cu307  1  0.949286  0.531191  0.691670  1
  Cu  Cu308  1  0.340798  0.536068  0.680478  1
  Cu  Cu309  1  0.733316  0.541156  0.669672  1
  Cu  Cu310  1  0.949286  0.031191  0.691670  1
  Cu  Cu311  1  0.340798  0.036068  0.680478  1
  Cu  Cu312  1  0.733316  0.041156  0.669672  1
  Cu  Cu313  1  0.770852  0.149592  0.703020  1
  Cu  Cu314  1  0.161661  0.155600  0.692729  1
  Cu  Cu315  1  0.377178  0.143993  0.712221  1
  Cu  Cu316  1  0.770852  0.649592  0.703020  1
  Cu  Cu317  1  0.161661  0.655600  0.692729  1
  Cu  Cu318  1  0.377178  0.643993  0.712221  1
  Cu  Cu319  1  0.983092  0.274683  0.703807  1
  Cu  Cu320  1  0.376077  0.280099  0.693994  1
  Cu  Cu321  1  0.593834  0.268442  0.713633  1
  Cu  Cu322  1  0.983092  0.774683  0.703807  1
  Cu  Cu323  1  0.376077  0.780099  0.693994  1
  Cu  Cu324  1  0.593834  0.768442  0.713633  1
  Cu  Cu325  1  0.683892  0.390018  0.717666  1
  Cu  Cu326  1  0.073761  0.397076  0.707673  1
  Cu  Cu327  1  0.464927  0.403287  0.698207  1
  Cu  Cu328  1  0.683892  0.890018  0.717666  1
  Cu  Cu329  1  0.073761  0.897076  0.707673  1
  Cu  Cu330  1  0.464927  0.903287  0.698207  1
  Cu  Cu331  1  0.768389  0.512963  0.721368  1
  Cu  Cu332  1  0.164170  0.519216  0.711239  1
  Cu  Cu333  1  0.554349  0.525353  0.702205  1
  Cu  Cu334  1  0.768389  0.012963  0.721368  1
  Cu  Cu335  1  0.164170  0.019216  0.711239  1
  Cu  Cu336  1  0.554349  0.025353  0.702205  1
