# generated using pymatgen
data_CuAg3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.53672157
_cell_length_b   23.84190023
_cell_length_c   49.46173066
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CuAg3
_chemical_formula_sum   'Cu42 Ag126'
_cell_volume   5349.98174894
_cell_formula_units_Z   42
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  0.253321  0.212515  0.324583  1
  Cu  Cu2  1  0.253321  0.999170  0.284558  1
  Cu  Cu3  1  0.253321  0.608050  0.303749  1
  Cu  Cu4  1  0.753321  0.346925  0.317466  1
  Cu  Cu5  1  0.753321  0.137954  0.277073  1
  Cu  Cu6  1  0.753321  0.739397  0.296561  1
  Cu  Cu7  1  0.253321  0.029792  0.390391  1
  Cu  Cu8  1  0.253321  0.818555  0.346800  1
  Cu  Cu9  1  0.253321  0.424059  0.367339  1
  Cu  Cu10  1  0.753321  0.161052  0.382732  1
  Cu  Cu11  1  0.753321  0.950282  0.339181  1
  Cu  Cu12  1  0.753321  0.556105  0.360113  1
  Cu  Cu13  1  0.253321  0.845805  0.457116  1
  Cu  Cu14  1  0.253321  0.635036  0.412590  1
  Cu  Cu15  1  0.253321  0.240533  0.434418  1
  Cu  Cu16  1  0.753321  0.976887  0.449622  1
  Cu  Cu17  1  0.753321  0.766264  0.405255  1
  Cu  Cu18  1  0.753321  0.371414  0.427008  1
  Cu  Cu19  1  0.253321  0.661599  0.523678  1
  Cu  Cu20  1  0.253321  0.450746  0.478979  1
  Cu  Cu21  1  0.253321  0.056362  0.501430  1
  Cu  Cu22  1  0.753321  0.792872  0.516412  1
  Cu  Cu23  1  0.753321  0.582020  0.471713  1
  Cu  Cu24  1  0.753321  0.187256  0.493962  1
  Cu  Cu25  1  0.253321  0.477354  0.590137  1
  Cu  Cu26  1  0.253321  0.266731  0.545770  1
  Cu  Cu27  1  0.253321  0.872204  0.568383  1
  Cu  Cu28  1  0.753321  0.608582  0.582802  1
  Cu  Cu29  1  0.753321  0.397813  0.538276  1
  Cu  Cu30  1  0.753321  1.003085  0.560973  1
  Cu  Cu31  1  0.253321  0.293336  0.656210  1
  Cu  Cu32  1  0.253321  0.082566  0.612660  1
  Cu  Cu33  1  0.253321  0.687513  0.635278  1
  Cu  Cu34  1  0.753321  0.425064  0.648592  1
  Cu  Cu35  1  0.753321  0.213826  0.605001  1
  Cu  Cu36  1  0.753321  0.819559  0.628053  1
  Cu  Cu37  1  0.253321  0.105664  0.718318  1
  Cu  Cu38  1  0.253321  0.896693  0.677925  1
  Cu  Cu39  1  0.253321  0.504221  0.698830  1
  Cu  Cu40  1  0.753321  0.244448  0.710834  1
  Cu  Cu41  1  0.753321  0.031103  0.670808  1
  Cu  Cu42  1  0.753321  0.635568  0.691643  1
  Ag  Ag43  1  0.753321  0.434490  0.281439  1
  Ag  Ag44  1  0.753321  0.039587  0.304010  1
  Ag  Ag45  1  0.753321  0.648228  0.326340  1
  Ag  Ag46  1  0.753321  0.147889  0.327414  1
  Ag  Ag47  1  0.753321  0.933162  0.281514  1
  Ag  Ag48  1  0.753321  0.541480  0.304873  1
  Ag  Ag49  1  0.753321  0.243653  0.293518  1
  Ag  Ag50  1  0.753321  0.842254  0.315468  1
  Ag  Ag51  1  0.753321  0.631396  0.270721  1
  Ag  Ag52  1  0.253321  0.309470  0.287547  1
  Ag  Ag53  1  0.253321  0.909015  0.313008  1
  Ag  Ag54  1  0.253321  0.697289  0.268891  1
  Ag  Ag55  1  0.253321  0.412945  0.311427  1
  Ag  Ag56  1  0.253321  0.199794  0.268598  1
  Ag  Ag57  1  0.253321  0.807910  0.286504  1
  Ag  Ag58  1  0.253321  0.507536  0.277636  1
  Ag  Ag59  1  0.253321  0.106659  0.300556  1
  Ag  Ag60  1  0.253321  0.717381  0.323265  1
  Ag  Ag61  1  0.753321  0.253033  0.348981  1
  Ag  Ag62  1  0.753321  0.858336  0.371248  1
  Ag  Ag63  1  0.753321  0.463750  0.393470  1
  Ag  Ag64  1  0.753321  0.963779  0.394179  1
  Ag  Ag65  1  0.753321  0.752778  0.350309  1
  Ag  Ag66  1  0.753321  0.358237  0.371497  1
  Ag  Ag67  1  0.753321  0.055278  0.360442  1
  Ag  Ag68  1  0.753321  0.659748  0.382824  1
  Ag  Ag69  1  0.753321  0.450097  0.338364  1
  Ag  Ag70  1  0.253321  0.121732  0.356770  1
  Ag  Ag71  1  0.253321  0.726800  0.379653  1
  Ag  Ag72  1  0.253321  0.516790  0.334989  1
  Ag  Ag73  1  0.253321  0.227365  0.378640  1
  Ag  Ag74  1  0.253321  0.015734  0.335308  1
  Ag  Ag75  1  0.253321  0.622758  0.356415  1
  Ag  Ag76  1  0.253321  0.319272  0.344129  1
  Ag  Ag77  1  0.253321  0.924414  0.368190  1
  Ag  Ag78  1  0.253321  0.530888  0.390018  1
  Ag  Ag79  1  0.753321  0.069033  0.415894  1
  Ag  Ag80  1  0.753321  0.674251  0.438180  1
  Ag  Ag81  1  0.753321  0.279424  0.460301  1
  Ag  Ag82  1  0.753321  0.779706  0.460956  1
  Ag  Ag83  1  0.753321  0.568812  0.416429  1
  Ag  Ag84  1  0.753321  0.174267  0.438476  1
  Ag  Ag85  1  0.753321  0.871102  0.427420  1
  Ag  Ag86  1  0.753321  0.475924  0.449432  1
  Ag  Ag87  1  0.753321  0.265829  0.404967  1
  Ag  Ag88  1  0.253321  0.937704  0.423914  1
  Ag  Ag89  1  0.253321  0.542727  0.446022  1
  Ag  Ag90  1  0.253321  0.332642  0.400820  1
  Ag  Ag91  1  0.253321  0.043081  0.445580  1
  Ag  Ag92  1  0.253321  0.832178  0.401422  1
  Ag  Ag93  1  0.253321  0.437662  0.423003  1
  Ag  Ag94  1  0.253321  0.135753  0.412123  1
  Ag  Ag95  1  0.253321  0.740887  0.434859  1
  Ag  Ag96  1  0.253321  0.346076  0.456410  1
  Ag  Ag97  1  0.753321  0.884908  0.482861  1
  Ag  Ag98  1  0.753321  0.490016  0.504717  1
  Ag  Ag99  1  0.753321  0.095290  0.527287  1
  Ag  Ag100  1  0.753321  0.595511  0.527474  1
  Ag  Ag101  1  0.753321  0.384614  0.482902  1
  Ag  Ag102  1  0.753321  0.990124  0.505475  1
  Ag  Ag103  1  0.753321  0.686947  0.494079  1
  Ag  Ag104  1  0.753321  0.291939  0.516226  1
  Ag  Ag105  1  0.753321  0.081606  0.471906  1
  Ag  Ag106  1  0.253321  0.753602  0.490674  1
  Ag  Ag107  1  0.253321  0.358710  0.512530  1
  Ag  Ag108  1  0.253321  0.148328  0.468105  1
  Ag  Ag109  1  0.253321  0.859004  0.512489  1
  Ag  Ag110  1  0.253321  0.648107  0.467918  1
  Ag  Ag111  1  0.253321  0.253494  0.489916  1
  Ag  Ag112  1  0.253321  0.951679  0.479165  1
  Ag  Ag113  1  0.253321  0.556671  0.501312  1
  Ag  Ag114  1  0.253321  0.162012  0.523486  1
  Ag  Ag115  1  0.753321  0.700891  0.549370  1
  Ag  Ag116  1  0.753321  0.305914  0.571477  1
  Ag  Ag117  1  0.753321  0.910976  0.594572  1
  Ag  Ag118  1  0.753321  0.411440  0.593970  1
  Ag  Ag119  1  0.753321  0.200537  0.549811  1
  Ag  Ag120  1  0.753321  0.805956  0.572388  1
  Ag  Ag121  1  0.753321  0.502731  0.560532  1
  Ag  Ag122  1  0.753321  0.107865  0.583269  1
  Ag  Ag123  1  0.753321  0.897542  0.538981  1
  Ag  Ag124  1  0.253321  0.569367  0.557212  1
  Ag  Ag125  1  0.253321  0.174585  0.579497  1
  Ag  Ag126  1  0.253321  0.964195  0.535090  1
  Ag  Ag127  1  0.253321  0.674806  0.578962  1
  Ag  Ag128  1  0.253321  0.463912  0.534436  1
  Ag  Ag129  1  0.253321  0.069351  0.556915  1
  Ag  Ag130  1  0.253321  0.767694  0.545959  1
  Ag  Ag131  1  0.253321  0.372516  0.567972  1
  Ag  Ag132  1  0.253321  0.977789  0.590425  1
  Ag  Ag133  1  0.753321  0.516818  0.615738  1
  Ag  Ag134  1  0.753321  0.121886  0.638622  1
  Ag  Ag135  1  0.753321  0.726828  0.660402  1
  Ag  Ag136  1  0.753321  0.227884  0.660084  1
  Ag  Ag137  1  0.753321  0.016253  0.616752  1
  Ag  Ag138  1  0.753321  0.620860  0.638977  1
  Ag  Ag139  1  0.753321  0.319204  0.627202  1
  Ag  Ag140  1  0.753321  0.924346  0.651262  1
  Ag  Ag141  1  0.753321  0.712730  0.605373  1
  Ag  Ag142  1  0.253321  0.385282  0.624144  1
  Ag  Ag143  1  0.253321  0.990585  0.646411  1
  Ag  Ag144  1  0.253321  0.779868  0.601922  1
  Ag  Ag145  1  0.253321  0.490840  0.645082  1
  Ag  Ag146  1  0.253321  0.279839  0.601212  1
  Ag  Ag147  1  0.253321  0.885381  0.623894  1
  Ag  Ag148  1  0.253321  0.583870  0.612567  1
  Ag  Ag149  1  0.253321  0.188340  0.634949  1
  Ag  Ag150  1  0.253321  0.793521  0.657028  1
  Ag  Ag151  1  0.753321  0.334603  0.682383  1
  Ag  Ag152  1  0.753321  0.934148  0.707844  1
  Ag  Ag153  1  0.753321  0.546329  0.726500  1
  Ag  Ag154  1  0.753321  0.043824  0.726794  1
  Ag  Ag155  1  0.753321  0.830673  0.683964  1
  Ag  Ag156  1  0.753321  0.435708  0.708888  1
  Ag  Ag157  1  0.753321  0.136959  0.694836  1
  Ag  Ag158  1  0.753321  0.736082  0.717756  1
  Ag  Ag159  1  0.753321  0.526237  0.672127  1
  Ag  Ag160  1  0.253321  0.204032  0.691382  1
  Ag  Ag161  1  0.253321  0.809128  0.713952  1
  Ag  Ag162  1  0.253321  0.595390  0.669052  1
  Ag  Ag163  1  0.253321  0.310456  0.713877  1
  Ag  Ag164  1  0.253321  0.095729  0.667978  1
  Ag  Ag165  1  0.253321  0.702138  0.690518  1
  Ag  Ag166  1  0.253321  0.401365  0.679924  1
  Ag  Ag167  1  0.253321  0.999965  0.701874  1
  Ag  Ag168  1  0.253321  0.612222  0.724670  1
