# generated using pymatgen
data_CuAg3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.60721977
_cell_length_b   17.37735725
_cell_length_c   50.86557557
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   80.74118523
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CuAg3
_chemical_formula_sum   'Cu36 Ag108'
_cell_volume   4891.7013892
_cell_formula_units_Z   36
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  0.929618  0.146105  0.315507  1
  Cu  Cu2  1  0.621601  0.762082  0.292106  1
  Cu  Cu3  1  0.239760  0.525667  0.340359  1
  Cu  Cu4  1  0.503566  0.998225  0.295383  1
  Cu  Cu5  1  0.195987  0.613411  0.272563  1
  Cu  Cu6  1  0.814809  0.375728  0.320296  1
  Cu  Cu7  1  0.859340  0.286517  0.392444  1
  Cu  Cu8  1  0.549340  0.906509  0.365913  1
  Cu  Cu9  1  0.169171  0.666822  0.418109  1
  Cu  Cu10  1  0.434684  0.135978  0.370910  1
  Cu  Cu11  1  0.124458  0.756464  0.344736  1
  Cu  Cu12  1  0.744297  0.516703  0.396728  1
  Cu  Cu13  1  0.789120  0.426873  0.469479  1
  Cu  Cu14  1  0.479340  0.046443  0.443482  1
  Cu  Cu15  1  0.098945  0.807195  0.495176  1
  Cu  Cu16  1  0.364390  0.276474  0.447962  1
  Cu  Cu17  1  0.054317  0.896654  0.422105  1
  Cu  Cu18  1  0.674032  0.657173  0.473790  1
  Cu  Cu19  1  0.718757  0.567518  0.546533  1
  Cu  Cu20  1  0.409115  0.186819  0.520705  1
  Cu  Cu21  1  0.028830  0.947337  0.572390  1
  Cu  Cu22  1  0.294027  0.417119  0.525017  1
  Cu  Cu23  1  0.984202  0.036797  0.499319  1
  Cu  Cu24  1  0.603807  0.797549  0.551013  1
  Cu  Cu25  1  0.648463  0.708014  0.623585  1
  Cu  Cu26  1  0.338849  0.327288  0.597767  1
  Cu  Cu27  1  0.958689  0.087527  0.649759  1
  Cu  Cu28  1  0.223807  0.557474  0.602052  1
  Cu  Cu29  1  0.913976  0.177170  0.576386  1
  Cu  Cu30  1  0.533807  0.937482  0.628582  1
  Cu  Cu31  1  0.579581  0.845767  0.699112  1
  Cu  Cu32  1  0.268337  0.468264  0.674199  1
  Cu  Cu33  1  0.887159  0.230580  0.721932  1
  Cu  Cu34  1  0.153529  0.697887  0.678988  1
  Cu  Cu35  1  0.843387  0.318325  0.654136  1
  Cu  Cu36  1  0.461546  0.081909  0.702390  1
  Ag  Ag37  1  0.694508  0.116417  0.270239  1
  Ag  Ag38  1  0.317113  0.874707  0.318460  1
  Ag  Ag39  1  0.004767  0.492937  0.293258  1
  Ag  Ag40  1  0.194605  0.116424  0.270230  1
  Ag  Ag41  1  0.813598  0.874704  0.318455  1
  Ag  Ag42  1  0.507635  0.492950  0.293248  1
  Ag  Ag43  1  0.005762  0.993896  0.293065  1
  Ag  Ag44  1  0.692641  0.620162  0.269573  1
  Ag  Ag45  1  0.313838  0.377699  0.320013  1
  Ag  Ag46  1  0.738710  0.026250  0.340474  1
  Ag  Ag47  1  0.427431  0.645919  0.316133  1
  Ag  Ag48  1  0.115232  0.268536  0.289881  1
  Ag  Ag49  1  0.240249  0.026251  0.340479  1
  Ag  Ag50  1  0.931909  0.645927  0.316136  1
  Ag  Ag51  1  0.621405  0.268548  0.289881  1
  Ag  Ag52  1  0.429142  0.147043  0.316216  1
  Ag  Ag53  1  0.120870  0.763567  0.288614  1
  Ag  Ag54  1  0.740449  0.524282  0.340592  1
  Ag  Ag55  1  0.627309  0.256604  0.345426  1
  Ag  Ag56  1  0.246847  0.015395  0.396187  1
  Ag  Ag57  1  0.936936  0.635628  0.371064  1
  Ag  Ag58  1  0.121546  0.256600  0.345421  1
  Ag  Ag59  1  0.743129  0.015396  0.396181  1
  Ag  Ag60  1  0.432831  0.635627  0.371059  1
  Ag  Ag61  1  0.934033  0.137290  0.370689  1
  Ag  Ag62  1  0.623519  0.758345  0.345602  1
  Ag  Ag63  1  0.243758  0.517786  0.396739  1
  Ag  Ag64  1  0.667170  0.166586  0.417880  1
  Ag  Ag65  1  0.356352  0.787188  0.392296  1
  Ag  Ag66  1  0.046824  0.407345  0.366913  1
  Ag  Ag67  1  0.171344  0.166586  0.417887  1
  Ag  Ag68  1  0.861587  0.787187  0.392305  1
  Ag  Ag69  1  0.550951  0.407345  0.366920  1
  Ag  Ag70  1  0.359908  0.285371  0.392475  1
  Ag  Ag71  1  0.050387  0.904408  0.365885  1
  Ag  Ag72  1  0.669717  0.665723  0.418127  1
  Ag  Ag73  1  0.556692  0.396259  0.422463  1
  Ag  Ag74  1  0.176746  0.156012  0.473549  1
  Ag  Ag75  1  0.866586  0.776520  0.447997  1
  Ag  Ag76  1  0.052403  0.396259  0.422456  1
  Ag  Ag77  1  0.672535  0.156012  0.473542  1
  Ag  Ag78  1  0.362229  0.776520  0.447989  1
  Ag  Ag79  1  0.863861  0.277547  0.447904  1
  Ag  Ag80  1  0.553734  0.897829  0.422130  1
  Ag  Ag81  1  0.173438  0.658376  0.473770  1
  Ag  Ag82  1  0.596798  0.307137  0.495030  1
  Ag  Ag83  1  0.286703  0.927361  0.469363  1
  Ag  Ag84  1  0.976657  0.547418  0.443842  1
  Ag  Ag85  1  0.101077  0.307137  0.495037  1
  Ag  Ag86  1  0.790965  0.927361  0.469370  1
  Ag  Ag87  1  0.480990  0.547419  0.443849  1
  Ag  Ag88  1  0.289652  0.425795  0.469551  1
  Ag  Ag89  1  0.979946  0.045220  0.443481  1
  Ag  Ag90  1  0.599537  0.805997  0.495166  1
  Ag  Ag91  1  0.486349  0.536855  0.499465  1
  Ag  Ag92  1  0.106490  0.296573  0.550653  1
  Ag  Ag93  1  0.796444  0.916631  0.525132  1
  Ag  Ag94  1  0.982070  0.536855  0.499459  1
  Ag  Ag95  1  0.602157  0.296573  0.550647  1
  Ag  Ag96  1  0.292182  0.916630  0.525125  1
  Ag  Ag97  1  0.793495  0.418196  0.524944  1
  Ag  Ag98  1  0.483610  0.037995  0.499329  1
  Ag  Ag99  1  0.103200  0.798771  0.551014  1
  Ag  Ag100  1  0.526455  0.447732  0.572032  1
  Ag  Ag101  1  0.216561  0.067471  0.546499  1
  Ag  Ag102  1  0.906401  0.687979  0.520947  1
  Ag  Ag103  1  0.030743  0.447733  0.572039  1
  Ag  Ag104  1  0.720918  0.067472  0.546506  1
  Ag  Ag105  1  0.410612  0.687979  0.520954  1
  Ag  Ag106  1  0.219286  0.566444  0.546591  1
  Ag  Ag107  1  0.909709  0.185616  0.520725  1
  Ag  Ag108  1  0.529413  0.946163  0.572366  1
  Ag  Ag109  1  0.415976  0.677405  0.576615  1
  Ag  Ag110  1  0.036323  0.436646  0.627583  1
  Ag  Ag111  1  0.726795  0.056803  0.602199  1
  Ag  Ag112  1  0.911803  0.677405  0.576609  1
  Ag  Ag113  1  0.532196  0.436646  0.627575  1
  Ag  Ag114  1  0.221560  0.056804  0.602190  1
  Ag  Ag115  1  0.723239  0.558621  0.602020  1
  Ag  Ag116  1  0.413430  0.178269  0.576368  1
  Ag  Ag117  1  0.032760  0.939583  0.628610  1
  Ag  Ag118  1  0.455838  0.587388  0.649069  1
  Ag  Ag119  1  0.146211  0.208363  0.623431  1
  Ag  Ag120  1  0.836300  0.828596  0.598308  1
  Ag  Ag121  1  0.961601  0.587392  0.649075  1
  Ag  Ag122  1  0.650316  0.208364  0.623436  1
  Ag  Ag123  1  0.340018  0.828596  0.598314  1
  Ag  Ag124  1  0.149114  0.706701  0.623807  1
  Ag  Ag125  1  0.839389  0.326205  0.597756  1
  Ag  Ag126  1  0.459628  0.085646  0.648893  1
  Ag  Ag127  1  0.344437  0.817742  0.654022  1
  Ag  Ag128  1  0.967915  0.575456  0.704614  1
  Ag  Ag129  1  0.655716  0.198072  0.678363  1
  Ag  Ag130  1  0.842898  0.817741  0.654017  1
  Ag  Ag131  1  0.461741  0.575443  0.704614  1
  Ag  Ag132  1  0.151238  0.198064  0.678360  1
  Ag  Ag133  1  0.654005  0.696948  0.678279  1
  Ag  Ag134  1  0.342698  0.319709  0.653903  1
  Ag  Ag135  1  0.962277  0.080425  0.705882  1
  Ag  Ag136  1  0.388639  0.727575  0.724256  1
  Ag  Ag137  1  0.078380  0.351054  0.701238  1
  Ag  Ag138  1  0.766034  0.969285  0.676035  1
  Ag  Ag139  1  0.888542  0.727568  0.724266  1
  Ag  Ag140  1  0.575512  0.351042  0.701247  1
  Ag  Ag141  1  0.269549  0.969288  0.676040  1
  Ag  Ag142  1  0.077385  0.850095  0.701430  1
  Ag  Ag143  1  0.769309  0.466293  0.674483  1
  Ag  Ag144  1  0.390506  0.223829  0.724922  1
