# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.56565933
_cell_length_b   13.06533436
_cell_length_c   48.40624906
_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   2255.07924019
_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  0.506881  0.332219  0.335740  1
  Cu  Cu2  1  0.506881  0.102739  0.294090  1
  Cu  Cu3  1  0.506881  0.717100  0.314827  1
  Cu  Cu4  1  0.006881  0.602739  0.294090  1
  Cu  Cu5  1  0.006881  0.217100  0.314827  1
  Cu  Cu6  1  0.006881  0.832219  0.335740  1
  Cu  Cu7  1  0.006881  0.410510  0.303842  1
  Cu  Cu8  1  0.006881  0.023913  0.324618  1
  Cu  Cu9  1  0.006881  0.794130  0.284775  1
  Cu  Cu10  1  0.506881  0.523913  0.324618  1
  Cu  Cu11  1  0.506881  0.294130  0.284775  1
  Cu  Cu12  1  0.506881  0.910510  0.303842  1
  Cu  Cu13  1  0.506881  0.178003  0.397969  1
  Cu  Cu14  1  0.506881  0.947325  0.356123  1
  Cu  Cu15  1  0.506881  0.562521  0.376965  1
  Cu  Cu16  1  0.006881  0.447325  0.356123  1
  Cu  Cu17  1  0.006881  0.062521  0.376965  1
  Cu  Cu18  1  0.006881  0.678003  0.397969  1
  Cu  Cu19  1  0.006881  0.254920  0.366843  1
  Cu  Cu20  1  0.006881  0.870514  0.387652  1
  Cu  Cu21  1  0.006881  0.639408  0.345797  1
  Cu  Cu22  1  0.506881  0.370514  0.387652  1
  Cu  Cu23  1  0.506881  0.139408  0.345797  1
  Cu  Cu24  1  0.506881  0.754920  0.366843  1
  Cu  Cu25  1  0.506881  0.024419  0.460544  1
  Cu  Cu26  1  0.506881  0.793571  0.418901  1
  Cu  Cu27  1  0.506881  0.409045  0.439730  1
  Cu  Cu28  1  0.006881  0.293571  0.418901  1
  Cu  Cu29  1  0.006881  0.909045  0.439730  1
  Cu  Cu30  1  0.006881  0.524419  0.460544  1
  Cu  Cu31  1  0.006881  0.101188  0.429218  1
  Cu  Cu32  1  0.006881  0.716634  0.450133  1
  Cu  Cu33  1  0.006881  0.485860  0.408362  1
  Cu  Cu34  1  0.506881  0.216634  0.450133  1
  Cu  Cu35  1  0.506881  0.985860  0.408362  1
  Cu  Cu36  1  0.506881  0.601188  0.429218  1
  Cu  Cu37  1  0.506881  0.870570  0.523122  1
  Cu  Cu38  1  0.506881  0.639759  0.481406  1
  Cu  Cu39  1  0.506881  0.255146  0.502270  1
  Cu  Cu40  1  0.006881  0.139759  0.481406  1
  Cu  Cu41  1  0.006881  0.755146  0.502270  1
  Cu  Cu42  1  0.006881  0.370570  0.523122  1
  Cu  Cu43  1  0.006881  0.947514  0.491861  1
  Cu  Cu44  1  0.006881  0.562901  0.512725  1
  Cu  Cu45  1  0.006881  0.332090  0.471010  1
  Cu  Cu46  1  0.506881  0.062901  0.512725  1
  Cu  Cu47  1  0.506881  0.832090  0.471010  1
  Cu  Cu48  1  0.506881  0.447514  0.491861  1
  Cu  Cu49  1  0.506881  0.716800  0.585769  1
  Cu  Cu50  1  0.506881  0.486026  0.543998  1
  Cu  Cu51  1  0.506881  0.101473  0.564914  1
  Cu  Cu52  1  0.006881  0.986026  0.543998  1
  Cu  Cu53  1  0.006881  0.601473  0.564914  1
  Cu  Cu54  1  0.006881  0.216800  0.585769  1
  Cu  Cu55  1  0.006881  0.793615  0.554402  1
  Cu  Cu56  1  0.006881  0.409089  0.575231  1
  Cu  Cu57  1  0.006881  0.178241  0.533588  1
  Cu  Cu58  1  0.506881  0.909089  0.575231  1
  Cu  Cu59  1  0.506881  0.678241  0.533588  1
  Cu  Cu60  1  0.506881  0.293615  0.554402  1
  Cu  Cu61  1  0.506881  0.563252  0.648334  1
  Cu  Cu62  1  0.506881  0.332146  0.606480  1
  Cu  Cu63  1  0.506881  0.947740  0.627289  1
  Cu  Cu64  1  0.006881  0.832146  0.606480  1
  Cu  Cu65  1  0.006881  0.447740  0.627289  1
  Cu  Cu66  1  0.006881  0.063252  0.648334  1
  Cu  Cu67  1  0.006881  0.640139  0.617166  1
  Cu  Cu68  1  0.006881  0.255335  0.638008  1
  Cu  Cu69  1  0.006881  0.024657  0.596162  1
  Cu  Cu70  1  0.506881  0.755335  0.638008  1
  Cu  Cu71  1  0.506881  0.524657  0.596162  1
  Cu  Cu72  1  0.506881  0.140139  0.617166  1
  Cu  Cu73  1  0.506881  0.408531  0.709357  1
  Cu  Cu74  1  0.506881  0.178747  0.669513  1
  Cu  Cu75  1  0.506881  0.792151  0.690289  1
  Cu  Cu76  1  0.006881  0.678747  0.669513  1
  Cu  Cu77  1  0.006881  0.292151  0.690289  1
  Cu  Cu78  1  0.006881  0.908531  0.709357  1
  Cu  Cu79  1  0.006881  0.485560  0.679305  1
  Cu  Cu80  1  0.006881  0.099921  0.700042  1
  Cu  Cu81  1  0.006881  0.870441  0.658391  1
  Cu  Cu82  1  0.506881  0.599921  0.700042  1
  Cu  Cu83  1  0.506881  0.370441  0.658391  1
  Cu  Cu84  1  0.506881  0.985560  0.679305  1
