# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.57181462
_cell_length_b   13.01028695
_cell_length_c   48.40187394
_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   2249.25120479
_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  1.006019  0.527704  0.324683  1
  Cu  Cu2  1  1.006019  0.297889  0.285322  1
  Cu  Cu3  1  1.006019  0.914427  0.303683  1
  Cu  Cu4  1  0.506019  0.414427  0.303683  1
  Cu  Cu5  1  0.506019  0.027704  0.324683  1
  Cu  Cu6  1  0.506019  0.797889  0.285322  1
  Cu  Cu7  1  0.506019  0.605806  0.293932  1
  Cu  Cu8  1  0.506019  0.220241  0.315026  1
  Cu  Cu9  1  0.506019  0.836251  0.335973  1
  Cu  Cu10  1  1.006019  0.336251  0.335973  1
  Cu  Cu11  1  1.006019  0.105806  0.293932  1
  Cu  Cu12  1  1.006019  0.720241  0.315026  1
  Cu  Cu13  1  1.006019  0.374007  0.387672  1
  Cu  Cu14  1  1.006019  0.143462  0.345932  1
  Cu  Cu15  1  1.006019  0.758640  0.366778  1
  Cu  Cu16  1  0.506019  0.258640  0.366778  1
  Cu  Cu17  1  0.506019  0.874007  0.387672  1
  Cu  Cu18  1  0.506019  0.643462  0.345932  1
  Cu  Cu19  1  0.506019  0.451156  0.356176  1
  Cu  Cu20  1  0.506019  0.066094  0.376937  1
  Cu  Cu21  1  0.506019  0.681360  0.397995  1
  Cu  Cu22  1  1.006019  0.181360  0.397995  1
  Cu  Cu23  1  1.006019  0.951156  0.356176  1
  Cu  Cu24  1  1.006019  0.566094  0.376937  1
  Cu  Cu25  1  1.006019  0.219307  0.450165  1
  Cu  Cu26  1  1.006019  0.989102  0.408385  1
  Cu  Cu27  1  1.006019  0.604128  0.429246  1
  Cu  Cu28  1  0.506019  0.104128  0.429246  1
  Cu  Cu29  1  0.506019  0.719307  0.450165  1
  Cu  Cu30  1  0.506019  0.489102  0.408385  1
  Cu  Cu31  1  0.506019  0.296607  0.418905  1
  Cu  Cu32  1  0.506019  0.911814  0.439760  1
  Cu  Cu33  1  0.506019  0.526943  0.460590  1
  Cu  Cu34  1  1.006019  0.026943  0.460590  1
  Cu  Cu35  1  1.006019  0.796607  0.418905  1
  Cu  Cu36  1  1.006019  0.411814  0.439760  1
  Cu  Cu37  1  1.006019  0.064842  0.512785  1
  Cu  Cu38  1  1.006019  0.834504  0.471047  1
  Cu  Cu39  1  1.006019  0.449688  0.491912  1
  Cu  Cu40  1  0.506019  0.949688  0.491912  1
  Cu  Cu41  1  0.506019  0.564842  0.512785  1
  Cu  Cu42  1  0.506019  0.334504  0.471047  1
  Cu  Cu43  1  0.506019  0.142062  0.481460  1
  Cu  Cu44  1  0.506019  0.757217  0.502333  1
  Cu  Cu45  1  0.506019  0.372400  0.523198  1
  Cu  Cu46  1  1.006019  0.872400  0.523198  1
  Cu  Cu47  1  1.006019  0.642062  0.481460  1
  Cu  Cu48  1  1.006019  0.257217  0.502333  1
  Cu  Cu49  1  1.006019  0.910297  0.575340  1
  Cu  Cu50  1  1.006019  0.679962  0.533654  1
  Cu  Cu51  1  1.006019  0.295090  0.554485  1
  Cu  Cu52  1  0.506019  0.795090  0.554485  1
  Cu  Cu53  1  0.506019  0.410297  0.575340  1
  Cu  Cu54  1  0.506019  0.179962  0.533654  1
  Cu  Cu55  1  0.506019  0.987597  0.544080  1
  Cu  Cu56  1  0.506019  0.602776  0.564999  1
  Cu  Cu57  1  0.506019  0.217802  0.585859  1
  Cu  Cu58  1  1.006019  0.717802  0.585859  1
  Cu  Cu59  1  1.006019  0.487597  0.544080  1
  Cu  Cu60  1  1.006019  0.102776  0.564999  1
  Cu  Cu61  1  1.006019  0.755748  0.638068  1
  Cu  Cu62  1  1.006019  0.525545  0.596250  1
  Cu  Cu63  1  1.006019  0.140810  0.617308  1
  Cu  Cu64  1  0.506019  0.640810  0.617308  1
  Cu  Cu65  1  0.506019  0.255748  0.638068  1
  Cu  Cu66  1  0.506019  0.025545  0.596250  1
  Cu  Cu67  1  0.506019  0.832897  0.606572  1
  Cu  Cu68  1  0.506019  0.448265  0.627467  1
  Cu  Cu69  1  0.506019  0.063443  0.648313  1
  Cu  Cu70  1  1.006019  0.563443  0.648313  1
  Cu  Cu71  1  1.006019  0.332897  0.606572  1
  Cu  Cu72  1  1.006019  0.948265  0.627467  1
  Cu  Cu73  1  1.006019  0.601098  0.700313  1
  Cu  Cu74  1  1.006019  0.370653  0.658271  1
  Cu  Cu75  1  1.006019  0.986663  0.679218  1
  Cu  Cu76  1  0.506019  0.486663  0.679218  1
  Cu  Cu77  1  0.506019  0.101098  0.700313  1
  Cu  Cu78  1  0.506019  0.870653  0.658271  1
  Cu  Cu79  1  0.506019  0.679200  0.669561  1
  Cu  Cu80  1  0.506019  0.292477  0.690562  1
  Cu  Cu81  1  0.506019  0.909015  0.708922  1
  Cu  Cu82  1  1.006019  0.409015  0.708922  1
  Cu  Cu83  1  1.006019  0.179200  0.669561  1
  Cu  Cu84  1  1.006019  0.792477  0.690562  1
