# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.25663967
_cell_length_b   11.04998742
_cell_length_c   47.51506440
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu168
_cell_volume   4335.07322222
_cell_formula_units_Z   168
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  0.504679  0.634298  0.294475  1
  Cu  Cu2  1  0.507087  0.417887  0.275963  1
  Cu  Cu3  1  0.503642  0.028240  0.284922  1
  Cu  Cu4  1  0.753716  0.374063  0.302703  1
  Cu  Cu5  1  0.753716  0.165668  0.281285  1
  Cu  Cu6  1  0.753716  0.770387  0.291148  1
  Cu  Cu7  1  1.002752  0.634298  0.294475  1
  Cu  Cu8  1  1.000344  0.417887  0.275963  1
  Cu  Cu9  1  0.003789  0.028240  0.284922  1
  Cu  Cu10  1  0.253716  0.500168  0.298307  1
  Cu  Cu11  1  0.253716  0.284153  0.278091  1
  Cu  Cu12  1  0.253716  0.890703  0.288315  1
  Cu  Cu13  1  0.502573  0.450019  0.328052  1
  Cu  Cu14  1  0.503456  0.236802  0.306728  1
  Cu  Cu15  1  0.504009  0.844080  0.316662  1
  Cu  Cu16  1  0.753716  0.187659  0.334869  1
  Cu  Cu17  1  0.753716  0.978771  0.312883  1
  Cu  Cu18  1  0.753716  0.583106  0.322694  1
  Cu  Cu19  1  0.004859  0.450019  0.328052  1
  Cu  Cu20  1  0.003976  0.236802  0.306728  1
  Cu  Cu21  1  1.003422  0.844080  0.316662  1
  Cu  Cu22  1  0.253716  0.316783  0.331101  1
  Cu  Cu23  1  0.253716  0.102661  0.309752  1
  Cu  Cu24  1  0.253716  0.709040  0.320094  1
  Cu  Cu25  1  0.503530  0.265068  0.359838  1
  Cu  Cu26  1  0.503869  0.053739  0.338513  1
  Cu  Cu27  1  0.504457  0.659826  0.348692  1
  Cu  Cu28  1  0.753716  1.002801  0.366734  1
  Cu  Cu29  1  0.753716  0.792838  0.345064  1
  Cu  Cu30  1  0.753716  0.398467  0.356032  1
  Cu  Cu31  1  0.003902  0.265068  0.359838  1
  Cu  Cu32  1  1.003563  0.053739  0.338513  1
  Cu  Cu33  1  1.002975  0.659826  0.348692  1
  Cu  Cu34  1  0.253716  0.131979  0.363245  1
  Cu  Cu35  1  0.253716  0.920527  0.341896  1
  Cu  Cu36  1  0.253716  0.526979  0.352567  1
  Cu  Cu37  1  0.503666  0.080594  0.392038  1
  Cu  Cu38  1  0.503846  0.869702  0.370346  1
  Cu  Cu39  1  0.503613  0.475911  0.381328  1
  Cu  Cu40  1  0.753716  0.818826  0.398965  1
  Cu  Cu41  1  0.753716  0.608599  0.377114  1
  Cu  Cu42  1  0.753716  0.213702  0.388403  1
  Cu  Cu43  1  0.003766  0.080594  0.392038  1
  Cu  Cu44  1  1.003586  0.869702  0.370346  1
  Cu  Cu45  1  0.003819  0.475911  0.381328  1
  Cu  Cu46  1  0.253716  0.947574  0.395581  1
  Cu  Cu47  1  0.253716  0.736823  0.373914  1
  Cu  Cu48  1  0.253716  0.342749  0.384909  1
  Cu  Cu49  1  0.503730  0.896445  0.424231  1
  Cu  Cu50  1  0.503843  0.686051  0.402637  1
  Cu  Cu51  1  0.503675  0.291416  0.413568  1
  Cu  Cu52  1  0.753716  0.634846  0.431228  1
  Cu  Cu53  1  0.753716  0.424528  0.409799  1
  Cu  Cu54  1  0.753716  0.029382  0.420599  1
  Cu  Cu55  1  1.003701  0.896445  0.424231  1
  Cu  Cu56  1  1.003589  0.686051  0.402637  1
  Cu  Cu57  1  0.003757  0.291416  0.413568  1
  Cu  Cu58  1  0.253716  0.763586  0.427891  1
  Cu  Cu59  1  0.253716  0.553284  0.406454  1
  Cu  Cu60  1  0.253716  0.158350  0.417157  1
  Cu  Cu61  1  0.503732  0.712431  0.456543  1
  Cu  Cu62  1  0.503702  0.502006  0.435077  1
  Cu  Cu63  1  0.503693  0.107100  0.445813  1
  Cu  Cu64  1  0.753716  0.450752  0.463648  1
  Cu  Cu65  1  0.753716  0.240131  0.442151  1
  Cu  Cu66  1  0.753716  0.845279  0.452849  1
  Cu  Cu67  1  1.003700  0.712431  0.456543  1
  Cu  Cu68  1  0.003730  0.502006  0.435077  1
  Cu  Cu69  1  0.003739  0.107100  0.445813  1
  Cu  Cu70  1  0.253716  0.579575  0.460286  1
  Cu  Cu71  1  0.253716  0.369005  0.438746  1
  Cu  Cu72  1  0.253716  0.974115  0.449454  1
  Cu  Cu73  1  0.503714  0.528336  0.488897  1
  Cu  Cu74  1  0.503702  0.317747  0.467363  1
  Cu  Cu75  1  0.503701  0.922917  0.478087  1
  Cu  Cu76  1  0.753716  0.266517  0.495959  1
  Cu  Cu77  1  0.753716  0.055870  0.474414  1
  Cu  Cu78  1  0.753716  0.661228  0.485159  1
  Cu  Cu79  1  0.003718  0.528336  0.488897  1
  Cu  Cu80  1  0.003729  0.317747  0.467363  1
  Cu  Cu81  1  0.003730  0.922917  0.478087  1
  Cu  Cu82  1  0.253716  0.395353  0.492570  1
  Cu  Cu83  1  0.253716  0.184727  0.471013  1
  Cu  Cu84  1  0.253716  0.790021  0.481796  1
  Cu  Cu85  1  0.503703  0.344131  0.521177  1
  Cu  Cu86  1  0.503694  0.133501  0.499629  1
  Cu  Cu87  1  0.503706  0.738826  0.510428  1
  Cu  Cu88  1  0.753716  0.082275  0.528224  1
  Cu  Cu89  1  0.753716  0.871700  0.506693  1
  Cu  Cu90  1  0.753716  0.477130  0.517504  1
  Cu  Cu91  1  0.003729  0.344131  0.521177  1
  Cu  Cu92  1  0.003738  0.133501  0.499629  1
  Cu  Cu93  1  0.003726  0.738826  0.510428  1
  Cu  Cu94  1  0.253716  0.211095  0.524851  1
  Cu  Cu95  1  0.253716  1.000511  0.503327  1
  Cu  Cu96  1  0.253716  0.605924  0.514126  1
  Cu  Cu97  1  0.503677  0.159863  0.553439  1
  Cu  Cu98  1  0.503677  0.949291  0.531933  1
  Cu  Cu99  1  0.503701  0.554729  0.542742  1
  Cu  Cu100  1  0.753716  0.898071  0.560504  1
  Cu  Cu101  1  0.753716  0.687631  0.539048  1
  Cu  Cu102  1  0.753716  0.292931  0.549774  1
  Cu  Cu103  1  0.003754  0.159863  0.553439  1
  Cu  Cu104  1  0.003755  0.949291  0.531933  1
  Cu  Cu105  1  0.003731  0.554729  0.542742  1
  Cu  Cu106  1  0.253716  0.026806  0.557194  1
  Cu  Cu107  1  0.253716  0.816380  0.535699  1
  Cu  Cu108  1  0.253716  0.421720  0.546391  1
  Cu  Cu109  1  0.503591  0.975590  0.585766  1
  Cu  Cu110  1  0.503684  0.765232  0.564334  1
  Cu  Cu111  1  0.503684  0.370506  0.575000  1
  Cu  Cu112  1  0.753716  0.714048  0.592945  1
  Cu  Cu113  1  0.753716  0.503571  0.571370  1
  Cu  Cu114  1  0.753716  0.108699  0.582018  1
  Cu  Cu115  1  0.003841  0.975590  0.585766  1
  Cu  Cu116  1  0.003748  0.765232  0.564334  1
  Cu  Cu117  1  0.003748  0.370506  0.575000  1
  Cu  Cu118  1  0.253716  0.842626  0.589664  1
  Cu  Cu119  1  0.253716  0.632321  0.567988  1
  Cu  Cu120  1  0.253716  0.237373  0.578676  1
  Cu  Cu121  1  0.503592  0.791810  0.618331  1
  Cu  Cu122  1  0.503664  0.581162  0.596587  1
  Cu  Cu123  1  0.503620  0.186103  0.607224  1
  Cu  Cu124  1  0.753716  0.530053  0.625283  1
  Cu  Cu125  1  0.753716  0.319391  0.603575  1
  Cu  Cu126  1  0.753716  0.924535  0.614211  1
  Cu  Cu127  1  0.003840  0.791810  0.618331  1
  Cu  Cu128  1  0.003768  0.581162  0.596587  1
  Cu  Cu129  1  0.003812  0.186103  0.607224  1
  Cu  Cu130  1  0.253716  0.658848  0.621914  1
  Cu  Cu131  1  0.253716  0.448102  0.600187  1
  Cu  Cu132  1  0.253716  0.052775  0.611061  1
  Cu  Cu133  1  0.503623  0.607770  0.650241  1
  Cu  Cu134  1  0.503681  0.396730  0.628839  1
  Cu  Cu135  1  0.503174  1.001798  0.639603  1
  Cu  Cu136  1  0.753716  0.345995  0.657272  1
  Cu  Cu137  1  0.753716  0.135401  0.635813  1
  Cu  Cu138  1  0.753716  0.740759  0.646777  1
  Cu  Cu139  1  0.003808  0.607770  0.650241  1
  Cu  Cu140  1  0.003750  0.396730  0.628839  1
  Cu  Cu141  1  0.004257  1.001798  0.639603  1
  Cu  Cu142  1  0.253716  0.474524  0.653788  1
  Cu  Cu143  1  0.253716  0.263540  0.632468  1
  Cu  Cu144  1  0.253716  0.868330  0.643815  1
  Cu  Cu145  1  0.503893  0.423876  0.682230  1
  Cu  Cu146  1  0.503296  0.211627  0.660878  1
  Cu  Cu147  1  0.504296  0.817920  0.672338  1
  Cu  Cu148  1  0.753716  0.164240  0.689286  1
  Cu  Cu149  1  0.753716  0.951551  0.667304  1
  Cu  Cu150  1  0.753716  0.558369  0.678884  1
  Cu  Cu151  1  1.003538  0.423876  0.682230  1
  Cu  Cu152  1  0.004135  0.211627  0.660878  1
  Cu  Cu153  1  1.003135  0.817920  0.672338  1
  Cu  Cu154  1  0.253716  0.290030  0.685742  1
  Cu  Cu155  1  0.253716  0.078006  0.664674  1
  Cu  Cu156  1  0.253716  0.682548  0.675811  1
  Cu  Cu157  1  0.505068  0.240965  0.713902  1
  Cu  Cu158  1  0.502240  0.026425  0.693484  1
  Cu  Cu159  1  0.503600  0.633562  0.703918  1
  Cu  Cu160  1  0.753716  0.981205  0.719228  1
  Cu  Cu161  1  0.753716  0.769200  0.700873  1
  Cu  Cu162  1  0.753716  0.377706  0.710752  1
  Cu  Cu163  1  1.002363  0.240965  0.713902  1
  Cu  Cu164  1  0.005192  0.026425  0.693484  1
  Cu  Cu165  1  0.003831  0.633562  0.703918  1
  Cu  Cu166  1  0.253716  0.109425  0.717161  1
  Cu  Cu167  1  0.253716  0.889664  0.698526  1
  Cu  Cu168  1  0.253716  0.495931  0.707655  1
