# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.53689266
_cell_length_b   6.04571837
_cell_length_c   48.73790196
_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   Cu28
_cell_volume   747.50970201
_cell_formula_units_Z   28
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  0.503775  0.325327  0.285748  1
  Cu  Cu2  1  0.003775  0.055551  0.315181  1
  Cu  Cu3  1  0.003775  0.650410  0.304915  1
  Cu  Cu4  1  0.503775  0.381897  0.335992  1
  Cu  Cu5  1  0.503775  0.790702  0.346622  1
  Cu  Cu6  1  0.003775  0.524950  0.377786  1
  Cu  Cu7  1  0.003775  0.114957  0.367000  1
  Cu  Cu8  1  0.503775  0.849228  0.398486  1
  Cu  Cu9  1  0.503775  0.258785  0.409024  1
  Cu  Cu10  1  0.003775  0.993067  0.440409  1
  Cu  Cu11  1  0.003775  0.582915  0.429803  1
  Cu  Cu12  1  0.503775  0.317014  0.461129  1
  Cu  Cu13  1  0.503775  0.727087  0.471733  1
  Cu  Cu14  1  0.003775  0.461121  0.503063  1
  Cu  Cu15  1  0.003775  0.051090  0.492476  1
  Cu  Cu16  1  0.503775  0.785124  0.523806  1
  Cu  Cu17  1  0.503775  0.195197  0.534410  1
  Cu  Cu18  1  0.003775  0.929296  0.565736  1
  Cu  Cu19  1  0.003775  0.519144  0.555130  1
  Cu  Cu20  1  0.503775  0.253426  0.586515  1
  Cu  Cu21  1  0.503775  0.662983  0.597053  1
  Cu  Cu22  1  0.003775  0.397254  0.628539  1
  Cu  Cu23  1  0.003775  0.987261  0.617754  1
  Cu  Cu24  1  0.503775  0.721510  0.648917  1
  Cu  Cu25  1  0.503775  0.130314  0.659547  1
  Cu  Cu26  1  0.003775  0.861801  0.690624  1
  Cu  Cu27  1  0.003775  0.456660  0.680358  1
  Cu  Cu28  1  0.503775  0.186884  0.709792  1
