# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.25611296
_cell_length_b   4.39382603
_cell_length_c   46.22790520
_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   Cu64
_cell_volume   1676.9599759
_cell_formula_units_Z   64
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  0.511089  0.865611  0.283739  1
  Cu  Cu2  1  0.753748  0.220090  0.282980  1
  Cu  Cu3  1  0.996407  0.865611  0.283739  1
  Cu  Cu4  1  0.253748  0.029735  0.308447  1
  Cu  Cu5  1  0.498813  0.374465  0.309565  1
  Cu  Cu6  1  0.753748  0.711020  0.310872  1
  Cu  Cu7  1  0.008682  0.374465  0.309565  1
  Cu  Cu8  1  0.253748  0.538427  0.336771  1
  Cu  Cu9  1  0.503864  0.877025  0.338207  1
  Cu  Cu10  1  0.753748  0.212478  0.337733  1
  Cu  Cu11  1  1.003632  0.877025  0.338207  1
  Cu  Cu12  1  0.253748  0.040292  0.364983  1
  Cu  Cu13  1  0.503580  0.377122  0.365302  1
  Cu  Cu14  1  0.753748  0.712758  0.365723  1
  Cu  Cu15  1  0.003916  0.377122  0.365302  1
  Cu  Cu16  1  0.253748  0.540562  0.392827  1
  Cu  Cu17  1  0.503231  0.877668  0.393326  1
  Cu  Cu18  1  0.753748  0.213518  0.393310  1
  Cu  Cu19  1  0.004265  0.877668  0.393326  1
  Cu  Cu20  1  0.253748  0.041200  0.420894  1
  Cu  Cu21  1  0.503490  0.378050  0.421019  1
  Cu  Cu22  1  0.753748  0.714206  0.421185  1
  Cu  Cu23  1  0.004006  0.378050  0.421019  1
  Cu  Cu24  1  0.253748  0.541455  0.448744  1
  Cu  Cu25  1  0.503611  0.878281  0.448916  1
  Cu  Cu26  1  0.753748  0.214738  0.448945  1
  Cu  Cu27  1  0.003884  0.878281  0.448916  1
  Cu  Cu28  1  0.253748  0.041652  0.476656  1
  Cu  Cu29  1  0.503684  0.378442  0.476721  1
  Cu  Cu30  1  0.753748  0.715068  0.476801  1
  Cu  Cu31  1  0.003812  0.378442  0.476721  1
  Cu  Cu32  1  0.253748  0.541787  0.504484  1
  Cu  Cu33  1  0.503749  0.878569  0.504593  1
  Cu  Cu34  1  0.753748  0.215368  0.504616  1
  Cu  Cu35  1  1.003747  0.878569  0.504593  1
  Cu  Cu36  1  0.253748  0.041916  0.532344  1
  Cu  Cu37  1  0.503825  0.378692  0.532417  1
  Cu  Cu38  1  0.753748  0.715698  0.532491  1
  Cu  Cu39  1  1.003671  0.378692  0.532417  1
  Cu  Cu40  1  0.253748  0.542088  0.560106  1
  Cu  Cu41  1  0.503871  0.878844  0.560322  1
  Cu  Cu42  1  0.753748  0.216066  0.560319  1
  Cu  Cu43  1  1.003625  0.878844  0.560322  1
  Cu  Cu44  1  0.253748  0.042379  0.587959  1
  Cu  Cu45  1  0.504075  0.379022  0.588120  1
  Cu  Cu46  1  0.753748  0.716775  0.588245  1
  Cu  Cu47  1  1.003421  0.379022  0.588120  1
  Cu  Cu48  1  0.253748  0.543016  0.615492  1
  Cu  Cu49  1  0.504072  0.879303  0.616186  1
  Cu  Cu50  1  0.753748  0.217487  0.616054  1
  Cu  Cu51  1  1.003424  0.879303  0.616186  1
  Cu  Cu52  1  0.253748  0.044120  0.643393  1
  Cu  Cu53  1  0.504477  0.379359  0.643784  1
  Cu  Cu54  1  0.753748  0.719271  0.643992  1
  Cu  Cu55  1  1.003019  0.379359  0.643784  1
  Cu  Cu56  1  0.253748  0.544512  0.669880  1
  Cu  Cu57  1  0.502298  0.878052  0.672145  1
  Cu  Cu58  1  0.753748  0.222112  0.671406  1
  Cu  Cu59  1  0.005198  0.878052  0.672145  1
  Cu  Cu60  1  0.253748  0.055777  0.698720  1
  Cu  Cu61  1  0.510108  0.377043  0.699691  1
  Cu  Cu62  1  0.753748  0.734397  0.699724  1
  Cu  Cu63  1  0.997388  0.377043  0.699691  1
  Cu  Cu64  1  0.253748  0.570020  0.722182  1
