# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.44244238
_cell_length_b   10.28107701
_cell_length_c   45.42741900
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   96.85284493
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu48
_cell_volume   1132.5756341
_cell_formula_units_Z   48
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  0.047019  0.582862  0.295397  1
  Cu  Cu2  1  0.332166  0.153393  0.278358  1
  Cu  Cu3  1  0.646358  0.780890  0.309126  1
  Cu  Cu4  1  0.930008  0.348361  0.291635  1
  Cu  Cu5  1  0.482623  0.454030  0.331628  1
  Cu  Cu6  1  0.763825  0.017097  0.312354  1
  Cu  Cu7  1  0.081642  0.651594  0.346078  1
  Cu  Cu8  1  0.363574  0.215741  0.328156  1
  Cu  Cu9  1  0.917278  0.323354  0.368359  1
  Cu  Cu10  1  0.199587  0.888094  0.349452  1
  Cu  Cu11  1  0.516250  0.520884  0.383387  1
  Cu  Cu12  1  0.797935  0.084357  0.364577  1
  Cu  Cu13  1  0.351928  0.192708  0.405278  1
  Cu  Cu14  1  0.634868  0.758539  0.386636  1
  Cu  Cu15  1  0.950786  0.389967  0.420533  1
  Cu  Cu16  1  0.233307  0.954975  0.401852  1
  Cu  Cu17  1  0.787034  0.062877  0.442489  1
  Cu  Cu18  1  0.069771  0.628313  0.423920  1
  Cu  Cu19  1  0.385663  0.259701  0.457675  1
  Cu  Cu20  1  0.668321  0.824982  0.439073  1
  Cu  Cu21  1  0.221986  0.932769  0.479680  1
  Cu  Cu22  1  0.504561  0.497901  0.461082  1
  Cu  Cu23  1  0.820606  0.129585  0.494872  1
  Cu  Cu24  1  0.103188  0.694730  0.476271  1
  Cu  Cu25  1  0.656857  0.802521  0.516859  1
  Cu  Cu26  1  0.939439  0.367666  0.498257  1
  Cu  Cu27  1  0.255484  0.999350  0.532047  1
  Cu  Cu28  1  0.538059  0.564482  0.513449  1
  Cu  Cu29  1  0.091724  0.672269  0.554056  1
  Cu  Cu30  1  0.374382  0.237550  0.535455  1
  Cu  Cu31  1  0.690274  0.868938  0.569210  1
  Cu  Cu32  1  0.973011  0.434374  0.550640  1
  Cu  Cu33  1  0.526738  0.542275  0.591278  1
  Cu  Cu34  1  0.809259  0.107283  0.572597  1
  Cu  Cu35  1  0.125177  0.738711  0.606493  1
  Cu  Cu36  1  0.408117  0.304542  0.587852  1
  Cu  Cu37  1  0.962110  0.412893  0.628553  1
  Cu  Cu38  1  0.243795  0.976366  0.609743  1
  Cu  Cu39  1  0.560458  0.609156  0.643678  1
  Cu  Cu40  1  0.842767  0.173897  0.624770  1
  Cu  Cu41  1  0.396471  0.281509  0.664973  1
  Cu  Cu42  1  0.678402  0.845657  0.647051  1
  Cu  Cu43  1  0.996220  0.480154  0.680775  1
  Cu  Cu44  1  0.277422  0.043220  0.661501  1
  Cu  Cu45  1  0.830037  0.148889  0.701494  1
  Cu  Cu46  1  0.113687  0.716361  0.684003  1
  Cu  Cu47  1  0.427879  0.343858  0.714771  1
  Cu  Cu48  1  0.713026  0.914388  0.697733  1
