# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.23852368
_cell_length_b   11.03715222
_cell_length_c   47.11808763
_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   2204.24214186
_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  0.250754  0.517764  0.298516  1
  Cu  Cu2  1  0.250754  0.301754  0.278250  1
  Cu  Cu3  1  0.250754  0.911567  0.288506  1
  Cu  Cu4  1  0.750754  0.382702  0.301489  1
  Cu  Cu5  1  0.750754  0.171510  0.281540  1
  Cu  Cu6  1  0.750754  0.777283  0.292081  1
  Cu  Cu7  1  0.250754  0.333065  0.330159  1
  Cu  Cu8  1  0.250754  0.121630  0.309203  1
  Cu  Cu9  1  0.250754  0.728447  0.319530  1
  Cu  Cu10  1  0.750754  0.199333  0.333865  1
  Cu  Cu11  1  0.750754  0.985988  0.312600  1
  Cu  Cu12  1  0.750754  0.592231  0.323245  1
  Cu  Cu13  1  0.250754  0.148057  0.362769  1
  Cu  Cu14  1  0.250754  0.937107  0.341191  1
  Cu  Cu15  1  0.250754  0.543164  0.351680  1
  Cu  Cu16  1  0.750754  0.015230  0.366323  1
  Cu  Cu17  1  0.750754  0.803732  0.344720  1
  Cu  Cu18  1  0.750754  0.409934  0.355386  1
  Cu  Cu19  1  0.250754  0.963624  0.395017  1
  Cu  Cu20  1  0.250754  0.752948  0.373472  1
  Cu  Cu21  1  0.250754  0.358666  0.384119  1
  Cu  Cu22  1  0.750754  0.831016  0.398618  1
  Cu  Cu23  1  0.750754  0.620220  0.377060  1
  Cu  Cu24  1  0.750754  0.225940  0.387836  1
  Cu  Cu25  1  0.250754  0.779393  0.427298  1
  Cu  Cu26  1  0.250754  0.568864  0.405705  1
  Cu  Cu27  1  0.250754  0.174305  0.416518  1
  Cu  Cu28  1  0.750754  0.646862  0.430929  1
  Cu  Cu29  1  0.750754  0.436293  0.409374  1
  Cu  Cu30  1  0.750754  0.041699  0.420170  1
  Cu  Cu31  1  0.250754  0.595221  0.459590  1
  Cu  Cu32  1  0.250754  0.384746  0.438029  1
  Cu  Cu33  1  0.250754  0.989993  0.448834  1
  Cu  Cu34  1  0.750754  0.462717  0.463254  1
  Cu  Cu35  1  0.750754  0.252206  0.441720  1
  Cu  Cu36  1  0.750754  0.857454  0.452485  1
  Cu  Cu37  1  0.250754  0.411043  0.491907  1
  Cu  Cu38  1  0.250754  0.200530  0.470367  1
  Cu  Cu39  1  0.250754  0.805761  0.481146  1
  Cu  Cu40  1  0.750754  0.278524  0.495579  1
  Cu  Cu41  1  0.750754  0.067993  0.474037  1
  Cu  Cu42  1  0.750754  0.673252  0.484802  1
  Cu  Cu43  1  0.250754  0.226828  0.524227  1
  Cu  Cu44  1  0.250754  0.016297  0.502684  1
  Cu  Cu45  1  0.250754  0.621568  0.513462  1
  Cu  Cu46  1  0.750754  0.094290  0.527896  1
  Cu  Cu47  1  0.750754  0.883778  0.506357  1
  Cu  Cu48  1  0.750754  0.489059  0.517118  1
  Cu  Cu49  1  0.250754  0.042614  0.556543  1
  Cu  Cu50  1  0.250754  0.832104  0.535010  1
  Cu  Cu51  1  0.250754  0.437366  0.545779  1
  Cu  Cu52  1  0.750754  0.910074  0.560234  1
  Cu  Cu53  1  0.750754  0.699599  0.538674  1
  Cu  Cu54  1  0.750754  0.304828  0.549430  1
  Cu  Cu55  1  0.250754  0.858527  0.588889  1
  Cu  Cu56  1  0.250754  0.647959  0.567335  1
  Cu  Cu57  1  0.250754  0.253122  0.578093  1
  Cu  Cu58  1  0.750754  0.725957  0.592558  1
  Cu  Cu59  1  0.750754  0.515427  0.570966  1
  Cu  Cu60  1  0.750754  0.120515  0.581745  1
  Cu  Cu61  1  0.250754  0.674601  0.621204  1
  Cu  Cu62  1  0.250754  0.463805  0.599645  1
  Cu  Cu63  1  0.250754  0.068880  0.610428  1
  Cu  Cu64  1  0.750754  0.541873  0.624792  1
  Cu  Cu65  1  0.750754  0.331196  0.603247  1
  Cu  Cu66  1  0.750754  0.936155  0.614145  1
  Cu  Cu67  1  0.250754  0.491088  0.653544  1
  Cu  Cu68  1  0.250754  0.279590  0.631940  1
  Cu  Cu69  1  0.250754  0.884886  0.642877  1
  Cu  Cu70  1  0.750754  0.357714  0.657072  1
  Cu  Cu71  1  0.750754  0.146763  0.635494  1
  Cu  Cu72  1  0.750754  0.751657  0.646583  1
  Cu  Cu73  1  0.250754  0.308833  0.685664  1
  Cu  Cu74  1  0.250754  0.095487  0.664398  1
  Cu  Cu75  1  0.250754  0.702590  0.675019  1
  Cu  Cu76  1  0.750754  0.173190  0.689061  1
  Cu  Cu77  1  0.750754  0.961755  0.668105  1
  Cu  Cu78  1  0.750754  0.566373  0.678734  1
  Cu  Cu79  1  0.250754  0.123310  0.716724  1
  Cu  Cu80  1  0.250754  0.912118  0.696774  1
  Cu  Cu81  1  0.250754  0.517537  0.706182  1
  Cu  Cu82  1  0.750754  0.993066  0.720013  1
  Cu  Cu83  1  0.750754  0.777056  0.699748  1
  Cu  Cu84  1  0.750754  0.383253  0.709758  1
