# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.61051248
_cell_length_b   13.07107756
_cell_length_c   48.57135170
_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   2292.24181956
_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  0.003957  0.620946  0.292194  1
  Cu  Cu2  1  0.003957  0.236239  0.311282  1
  Cu  Cu3  1  0.003957  0.849977  0.331003  1
  Cu  Cu4  1  0.503957  0.351366  0.332139  1
  Cu  Cu5  1  0.503957  0.121635  0.291539  1
  Cu  Cu6  1  0.503957  0.736023  0.311281  1
  Cu  Cu7  1  0.503957  0.542715  0.321044  1
  Cu  Cu8  1  0.503957  0.313704  0.282215  1
  Cu  Cu9  1  0.503957  0.928944  0.301453  1
  Cu  Cu10  1  0.003957  0.428686  0.301187  1
  Cu  Cu11  1  0.003957  0.043312  0.321234  1
  Cu  Cu12  1  0.003957  0.659043  0.342192  1
  Cu  Cu13  1  0.003957  0.467514  0.352356  1
  Cu  Cu14  1  0.003957  0.081867  0.373222  1
  Cu  Cu15  1  0.003957  0.697098  0.394087  1
  Cu  Cu16  1  0.503957  0.196922  0.394236  1
  Cu  Cu17  1  0.503957  0.966544  0.352098  1
  Cu  Cu18  1  0.503957  0.582251  0.373197  1
  Cu  Cu19  1  0.503957  0.389799  0.383918  1
  Cu  Cu20  1  0.503957  0.159050  0.342016  1
  Cu  Cu21  1  0.503957  0.774964  0.362562  1
  Cu  Cu22  1  0.003957  0.274616  0.363095  1
  Cu  Cu23  1  0.003957  0.889338  0.383358  1
  Cu  Cu24  1  0.003957  0.504564  0.404626  1
  Cu  Cu25  1  0.003957  0.311822  0.415249  1
  Cu  Cu26  1  0.003957  0.926534  0.435819  1
  Cu  Cu27  1  0.003957  0.541487  0.456899  1
  Cu  Cu28  1  0.503957  0.041364  0.456831  1
  Cu  Cu29  1  0.503957  0.811789  0.414897  1
  Cu  Cu30  1  0.503957  0.426705  0.436079  1
  Cu  Cu31  1  0.503957  0.234004  0.446522  1
  Cu  Cu32  1  0.503957  0.004110  0.404432  1
  Cu  Cu33  1  0.503957  0.619234  0.425502  1
  Cu  Cu34  1  0.003957  0.119103  0.425510  1
  Cu  Cu35  1  0.003957  0.734061  0.446354  1
  Cu  Cu36  1  0.003957  0.348875  0.467449  1
  Cu  Cu37  1  0.003957  0.156242  0.477840  1
  Cu  Cu38  1  0.003957  0.771171  0.498633  1
  Cu  Cu39  1  0.003957  0.385960  0.519679  1
  Cu  Cu40  1  0.503957  0.886033  0.519589  1
  Cu  Cu41  1  0.503957  0.656314  0.477750  1
  Cu  Cu42  1  0.503957  0.271103  0.498796  1
  Cu  Cu43  1  0.503957  0.078557  0.509214  1
  Cu  Cu44  1  0.503957  0.848887  0.467248  1
  Cu  Cu45  1  0.503957  0.463727  0.488296  1
  Cu  Cu46  1  0.003957  0.963717  0.488215  1
  Cu  Cu47  1  0.003957  0.578547  0.509133  1
  Cu  Cu48  1  0.003957  0.193388  0.530180  1
  Cu  Cu49  1  0.003957  1.000910  0.540598  1
  Cu  Cu50  1  0.003957  0.615570  0.561350  1
  Cu  Cu51  1  0.003957  0.230485  0.582532  1
  Cu  Cu52  1  0.503957  0.730452  0.582180  1
  Cu  Cu53  1  0.503957  0.500787  0.540530  1
  Cu  Cu54  1  0.503957  0.115740  0.561609  1
  Cu  Cu55  1  0.503957  0.923171  0.571919  1
  Cu  Cu56  1  0.503957  0.693399  0.529980  1
  Cu  Cu57  1  0.503957  0.308213  0.551075  1
  Cu  Cu58  1  0.003957  0.808270  0.550907  1
  Cu  Cu59  1  0.003957  0.423040  0.571927  1
  Cu  Cu60  1  0.003957  0.038164  0.592997  1
  Cu  Cu61  1  0.003957  0.845352  0.603193  1
  Cu  Cu62  1  0.003957  0.460024  0.624232  1
  Cu  Cu63  1  0.003957  0.075731  0.645331  1
  Cu  Cu64  1  0.503957  0.574761  0.645072  1
  Cu  Cu65  1  0.503957  0.345176  0.603342  1
  Cu  Cu66  1  0.503957  0.960408  0.624207  1
  Cu  Cu67  1  0.503957  0.767658  0.634334  1
  Cu  Cu68  1  0.503957  0.537711  0.592802  1
  Cu  Cu69  1  0.503957  0.152937  0.614071  1
  Cu  Cu70  1  0.003957  0.652476  0.613511  1
  Cu  Cu71  1  0.003957  0.267310  0.634867  1
  Cu  Cu72  1  0.003957  0.883224  0.655412  1
  Cu  Cu73  1  0.003957  0.690908  0.665290  1
  Cu  Cu74  1  0.003957  0.306251  0.686147  1
  Cu  Cu75  1  0.003957  0.920639  0.705890  1
  Cu  Cu76  1  0.503957  0.421329  0.705235  1
  Cu  Cu77  1  0.503957  0.192298  0.666425  1
  Cu  Cu78  1  0.503957  0.806035  0.686147  1
  Cu  Cu79  1  0.503957  0.613588  0.696241  1
  Cu  Cu80  1  0.503957  0.383232  0.655237  1
  Cu  Cu81  1  0.503957  0.998963  0.676195  1
  Cu  Cu82  1  0.003957  0.499559  0.676385  1
  Cu  Cu83  1  0.003957  0.113330  0.695975  1
  Cu  Cu84  1  0.003957  0.728570  0.715214  1
