# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.16016137
_cell_length_b   11.08226520
_cell_length_c   47.39366486
_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   Cu84
_cell_volume   2185.03807346
_cell_formula_units_Z   84
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  0.751461  0.518101  0.296962  1
  Cu  Cu2  1  0.751461  0.301673  0.277007  1
  Cu  Cu3  1  0.751461  0.911457  0.287066  1
  Cu  Cu4  1  0.251461  0.383320  0.300647  1
  Cu  Cu5  1  0.251461  0.169614  0.280245  1
  Cu  Cu6  1  0.251461  0.776439  0.290647  1
  Cu  Cu7  1  0.751461  0.333146  0.329539  1
  Cu  Cu8  1  0.751461  0.120611  0.308498  1
  Cu  Cu9  1  0.751461  0.727826  0.318713  1
  Cu  Cu10  1  0.251461  0.199379  0.333211  1
  Cu  Cu11  1  0.251461  0.986001  0.311873  1
  Cu  Cu12  1  0.251461  0.592513  0.322344  1
  Cu  Cu13  1  0.751461  0.148213  0.361943  1
  Cu  Cu14  1  0.751461  0.936840  0.340581  1
  Cu  Cu15  1  0.751461  0.543046  0.350886  1
  Cu  Cu16  1  0.251461  0.015056  0.365528  1
  Cu  Cu17  1  0.251461  0.803335  0.344088  1
  Cu  Cu18  1  0.251461  0.409565  0.354707  1
  Cu  Cu19  1  0.751461  0.963721  0.394235  1
  Cu  Cu20  1  0.751461  0.752814  0.372690  1
  Cu  Cu21  1  0.751461  0.358760  0.383364  1
  Cu  Cu22  1  0.251461  0.830803  0.397835  1
  Cu  Cu23  1  0.251461  0.619788  0.376268  1
  Cu  Cu24  1  0.251461  0.225685  0.387090  1
  Cu  Cu25  1  0.751461  0.779489  0.426489  1
  Cu  Cu26  1  0.751461  0.568902  0.404904  1
  Cu  Cu27  1  0.751461  0.174400  0.415720  1
  Cu  Cu28  1  0.251461  0.646673  0.430121  1
  Cu  Cu29  1  0.251461  0.436060  0.408618  1
  Cu  Cu30  1  0.251461  0.041487  0.419380  1
  Cu  Cu31  1  0.751461  0.595367  0.458765  1
  Cu  Cu32  1  0.751461  0.384845  0.437238  1
  Cu  Cu33  1  0.751461  0.990121  0.448021  1
  Cu  Cu34  1  0.251461  0.462583  0.462451  1
  Cu  Cu35  1  0.251461  0.252009  0.440933  1
  Cu  Cu36  1  0.251461  0.857281  0.451674  1
  Cu  Cu37  1  0.751461  0.411233  0.491077  1
  Cu  Cu38  1  0.751461  0.200671  0.469550  1
  Cu  Cu39  1  0.751461  0.805920  0.480311  1
  Cu  Cu40  1  0.251461  0.278423  0.494753  1
  Cu  Cu41  1  0.251461  0.067841  0.473219  1
  Cu  Cu42  1  0.251461  0.673125  0.483978  1
  Cu  Cu43  1  0.751461  0.227060  0.523376  1
  Cu  Cu44  1  0.751461  0.016478  0.501842  1
  Cu  Cu45  1  0.751461  0.621776  0.512617  1
  Cu  Cu46  1  0.251461  0.094230  0.527045  1
  Cu  Cu47  1  0.251461  0.883667  0.505518  1
  Cu  Cu48  1  0.251461  0.488980  0.516284  1
  Cu  Cu49  1  0.751461  0.042892  0.555662  1
  Cu  Cu50  1  0.751461  0.832317  0.534144  1
  Cu  Cu51  1  0.751461  0.437619  0.544921  1
  Cu  Cu52  1  0.251461  0.910056  0.559357  1
  Cu  Cu53  1  0.251461  0.699533  0.537830  1
  Cu  Cu54  1  0.251461  0.304779  0.548574  1
  Cu  Cu55  1  0.751461  0.858841  0.587977  1
  Cu  Cu56  1  0.751461  0.648228  0.566473  1
  Cu  Cu57  1  0.751461  0.253414  0.577215  1
  Cu  Cu58  1  0.251461  0.725999  0.591691  1
  Cu  Cu59  1  0.251461  0.515411  0.570106  1
  Cu  Cu60  1  0.251461  0.120501  0.580875  1
  Cu  Cu61  1  0.751461  0.675113  0.620327  1
  Cu  Cu62  1  0.751461  0.464097  0.598760  1
  Cu  Cu63  1  0.751461  0.069215  0.609505  1
  Cu  Cu64  1  0.251461  0.542086  0.623905  1
  Cu  Cu65  1  0.251461  0.331179  0.602360  1
  Cu  Cu66  1  0.251461  0.936141  0.613231  1
  Cu  Cu67  1  0.751461  0.491565  0.652507  1
  Cu  Cu68  1  0.751461  0.279844  0.631067  1
  Cu  Cu69  1  0.751461  0.885335  0.641888  1
  Cu  Cu70  1  0.251461  0.358060  0.656014  1
  Cu  Cu71  1  0.251461  0.146687  0.634652  1
  Cu  Cu72  1  0.251461  0.751855  0.645709  1
  Cu  Cu73  1  0.751461  0.308900  0.684722  1
  Cu  Cu74  1  0.751461  0.095522  0.663384  1
  Cu  Cu75  1  0.751461  0.702387  0.674251  1
  Cu  Cu76  1  0.251461  0.174289  0.688097  1
  Cu  Cu77  1  0.251461  0.961754  0.667056  1
  Cu  Cu78  1  0.251461  0.567074  0.677882  1
  Cu  Cu79  1  0.751461  0.125286  0.716350  1
  Cu  Cu80  1  0.751461  0.911580  0.695948  1
  Cu  Cu81  1  0.751461  0.518462  0.705948  1
  Cu  Cu82  1  0.251461  0.993227  0.719588  1
  Cu  Cu83  1  0.251461  0.776800  0.699633  1
  Cu  Cu84  1  0.251461  0.383443  0.709529  1
