# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.19613976
_cell_length_b   4.91087320
_cell_length_c   45.87600707
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   68.83285641
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu72
_cell_volume   1932.02695982
_cell_formula_units_Z   72
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  0.821636  0.448993  0.296934  1
  Cu  Cu2  1  0.099473  0.395415  0.308289  1
  Cu  Cu3  1  0.544771  0.500804  0.285225  1
  Cu  Cu4  1  0.886028  0.907298  0.306217  1
  Cu  Cu5  1  0.331241  0.004889  0.283917  1
  Cu  Cu6  1  0.608652  0.957496  0.294713  1
  Cu  Cu7  1  0.659731  0.288184  0.333043  1
  Cu  Cu8  1  0.939560  0.234154  0.345106  1
  Cu  Cu9  1  0.377988  0.348023  0.320070  1
  Cu  Cu10  1  0.726880  0.743605  0.342865  1
  Cu  Cu11  1  0.165152  0.852875  0.318014  1
  Cu  Cu12  1  0.447139  0.798993  0.331030  1
  Cu  Cu13  1  0.497654  0.128901  0.369664  1
  Cu  Cu14  1  0.777917  0.073017  0.382163  1
  Cu  Cu15  1  0.218370  0.181437  0.356888  1
  Cu  Cu16  1  0.565032  0.583929  0.380045  1
  Cu  Cu17  1  0.005764  0.690839  0.354775  1
  Cu  Cu18  1  0.284623  0.637892  0.367334  1
  Cu  Cu19  1  0.336323  0.966346  0.406753  1
  Cu  Cu20  1  0.616118  0.912300  0.419326  1
  Cu  Cu21  1  0.057227  0.019259  0.394429  1
  Cu  Cu22  1  0.403647  0.422357  0.416971  1
  Cu  Cu23  1  0.844857  0.529624  0.392234  1
  Cu  Cu24  1  0.124212  0.475747  0.404404  1
  Cu  Cu25  1  0.175349  0.803808  0.444033  1
  Cu  Cu26  1  0.454863  0.750169  0.456443  1
  Cu  Cu27  1  0.895937  0.857697  0.431716  1
  Cu  Cu28  1  0.242663  0.260198  0.454074  1
  Cu  Cu29  1  0.683560  0.368016  0.429401  1
  Cu  Cu30  1  0.963247  0.314003  0.441705  1
  Cu  Cu31  1  0.014210  0.641872  0.481263  1
  Cu  Cu32  1  0.293750  0.588012  0.493646  1
  Cu  Cu33  1  0.734575  0.695993  0.468880  1
  Cu  Cu34  1  0.081529  0.098186  0.491281  1
  Cu  Cu35  1  0.522227  0.206388  0.466534  1
  Cu  Cu36  1  0.801907  0.152259  0.478910  1
  Cu  Cu37  1  0.852908  0.480107  0.518436  1
  Cu  Cu38  1  0.132587  0.425978  0.530811  1
  Cu  Cu39  1  0.573285  0.534180  0.506065  1
  Cu  Cu40  1  0.920240  0.936373  0.528466  1
  Cu  Cu41  1  0.361064  0.044354  0.503700  1
  Cu  Cu42  1  0.640605  0.990494  0.516082  1
  Cu  Cu43  1  0.691567  0.318363  0.555641  1
  Cu  Cu44  1  0.971255  0.264350  0.567945  1
  Cu  Cu45  1  0.412151  0.372168  0.543272  1
  Cu  Cu46  1  0.758877  0.774669  0.565630  1
  Cu  Cu47  1  0.199951  0.882197  0.540902  1
  Cu  Cu48  1  0.479465  0.828558  0.553313  1
  Cu  Cu49  1  0.530603  0.156619  0.592942  1
  Cu  Cu50  1  0.809957  0.102742  0.605112  1
  Cu  Cu51  1  0.251168  0.210009  0.580375  1
  Cu  Cu52  1  0.597587  0.613107  0.602916  1
  Cu  Cu53  1  0.038696  0.720066  0.578020  1
  Cu  Cu54  1  0.318491  0.666021  0.590593  1
  Cu  Cu55  1  0.370191  0.994474  0.630011  1
  Cu  Cu56  1  0.649050  0.941527  0.642571  1
  Cu  Cu57  1  0.089782  0.048437  0.617301  1
  Cu  Cu58  1  0.436444  0.450929  0.640458  1
  Cu  Cu59  1  0.876897  0.559349  0.615183  1
  Cu  Cu60  1  0.157161  0.503465  0.627682  1
  Cu  Cu61  1  0.207675  0.833373  0.666316  1
  Cu  Cu62  1  0.489662  0.779491  0.679332  1
  Cu  Cu63  1  0.927935  0.888762  0.654481  1
  Cu  Cu64  1  0.276826  0.284343  0.677276  1
  Cu  Cu65  1  0.715255  0.398212  0.652239  1
  Cu  Cu66  1  0.995083  0.344182  0.664303  1
  Cu  Cu67  1  0.046162  0.674870  0.702632  1
  Cu  Cu68  1  0.323573  0.627477  0.713429  1
  Cu  Cu69  1  0.768786  0.725068  0.691129  1
  Cu  Cu70  1  0.110044  0.131562  0.712121  1
  Cu  Cu71  1  0.555341  0.236951  0.689057  1
  Cu  Cu72  1  0.833179  0.183373  0.700412  1
