# generated using pymatgen
data_CuAg3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.53868117
_cell_length_b   19.73548385
_cell_length_c   51.77208062
_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   'Cu36 Ag108'
_cell_volume   4637.38414689
_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  0.277355  0.750201  0.281018  1
  Cu  Cu2  1  0.223528  0.289416  0.328517  1
  Cu  Cu3  1  0.273396  0.018555  0.305574  1
  Cu  Cu4  1  0.771698  0.716032  0.335900  1
  Cu  Cu5  1  0.754223  0.448450  0.313003  1
  Cu  Cu6  1  0.672863  0.186681  0.288367  1
  Cu  Cu7  1  0.267185  0.559042  0.352740  1
  Cu  Cu8  1  0.241090  0.099379  0.404371  1
  Cu  Cu9  1  0.260251  0.829759  0.378359  1
  Cu  Cu10  1  0.756488  0.522173  0.412786  1
  Cu  Cu11  1  0.742363  0.253499  0.387226  1
  Cu  Cu12  1  0.749317  0.983304  0.360924  1
  Cu  Cu13  1  0.252958  0.368421  0.429567  1
  Cu  Cu14  1  0.253042  0.906868  0.480954  1
  Cu  Cu15  1  0.255546  0.637701  0.455249  1
  Cu  Cu16  1  0.753939  0.329904  0.489711  1
  Cu  Cu17  1  0.751352  0.060418  0.464078  1
  Cu  Cu18  1  0.755507  0.791466  0.438234  1
  Cu  Cu19  1  0.252268  0.176149  0.506668  1
  Cu  Cu20  1  0.250700  0.714587  0.558145  1
  Cu  Cu21  1  0.254855  0.445635  0.532302  1
  Cu  Cu22  1  0.753249  0.137632  0.566812  1
  Cu  Cu23  1  0.750661  0.868351  0.541130  1
  Cu  Cu24  1  0.753165  0.599185  0.515425  1
  Cu  Cu25  1  0.249719  0.983880  0.583594  1
  Cu  Cu26  1  0.256890  0.522749  0.635456  1
  Cu  Cu27  1  0.263843  0.252554  0.609154  1
  Cu  Cu28  1  0.739021  0.947011  0.643639  1
  Cu  Cu29  1  0.745956  0.676294  0.618021  1
  Cu  Cu30  1  0.765116  0.406674  0.592009  1
  Cu  Cu31  1  0.234509  0.790021  0.660480  1
  Cu  Cu32  1  0.333344  0.319372  0.708013  1
  Cu  Cu33  1  0.251984  0.057603  0.683377  1
  Cu  Cu34  1  0.728851  0.755852  0.715362  1
  Cu  Cu35  1  0.732811  0.487498  0.690806  1
  Cu  Cu36  1  0.782679  0.216636  0.667863  1
  Ag  Ag37  1  0.774468  0.808665  0.296282  1
  Ag  Ag38  1  0.791558  0.533096  0.272153  1
  Ag  Ag39  1  0.720689  0.079374  0.324001  1
  Ag  Ag40  1  0.783925  0.671703  0.282460  1
  Ag  Ag41  1  0.720974  0.216254  0.335454  1
  Ag  Ag42  1  0.775338  0.947467  0.307047  1
  Ag  Ag43  1  0.787403  0.581587  0.323360  1
  Ag  Ag44  1  0.664042  0.320351  0.296770  1
  Ag  Ag45  1  0.921098  0.074719  0.273975  1
  Ag  Ag46  1  0.286095  0.657191  0.314033  1
  Ag  Ag47  1  0.166285  0.394685  0.284093  1
  Ag  Ag48  1  0.270129  0.926674  0.339639  1
  Ag  Ag49  1  0.272271  0.792087  0.327740  1
  Ag  Ag50  1  0.289130  0.524173  0.300957  1
  Ag  Ag51  1  0.160921  0.254276  0.277162  1
  Ag  Ag52  1  0.274585  0.887272  0.286782  1
  Ag  Ag53  1  0.254990  0.424054  0.338030  1
  Ag  Ag54  1  0.210996  0.153823  0.313225  1
  Ag  Ag55  1  0.758830  0.617545  0.374477  1
  Ag  Ag56  1  0.753280  0.348830  0.348642  1
  Ag  Ag57  1  0.755583  0.886602  0.399706  1
  Ag  Ag58  1  0.756819  0.483783  0.361313  1
  Ag  Ag59  1  0.754166  0.021953  0.412230  1
  Ag  Ag60  1  0.758373  0.753294  0.386242  1
  Ag  Ag61  1  0.755330  0.388064  0.400143  1
  Ag  Ag62  1  0.721668  0.120176  0.374782  1
  Ag  Ag63  1  0.771035  0.851150  0.347899  1
  Ag  Ag64  1  0.255883  0.465204  0.390634  1
  Ag  Ag65  1  0.222113  0.196206  0.365110  1
  Ag  Ag66  1  0.258026  0.734827  0.416425  1
  Ag  Ag67  1  0.258163  0.599143  0.404361  1
  Ag  Ag68  1  0.254470  0.330413  0.378426  1
  Ag  Ag69  1  0.220969  0.061123  0.353766  1
  Ag  Ag70  1  0.259231  0.693986  0.365145  1
  Ag  Ag71  1  0.247454  0.233163  0.416440  1
  Ag  Ag72  1  0.255036  0.963623  0.390956  1
  Ag  Ag73  1  0.755057  0.424988  0.451391  1
  Ag  Ag74  1  0.747395  0.155785  0.425953  1
  Ag  Ag75  1  0.753331  0.694218  0.477084  1
  Ag  Ag76  1  0.748323  0.291144  0.438059  1
  Ag  Ag77  1  0.753095  0.829576  0.489312  1
  Ag  Ag78  1  0.755221  0.560491  0.463574  1
  Ag  Ag79  1  0.748361  0.196072  0.477230  1
  Ag  Ag80  1  0.754848  0.926550  0.451325  1
  Ag  Ag81  1  0.758036  0.657973  0.425700  1
  Ag  Ag82  1  0.248483  0.273342  0.467898  1
  Ag  Ag83  1  0.254732  0.003993  0.442337  1
  Ag  Ag84  1  0.255031  0.542694  0.493625  1
  Ag  Ag85  1  0.255108  0.407220  0.481341  1
  Ag  Ag86  1  0.248145  0.137939  0.455783  1
  Ag  Ag87  1  0.255117  0.868548  0.429926  1
  Ag  Ag88  1  0.255322  0.502099  0.442139  1
  Ag  Ag89  1  0.251047  0.040701  0.493633  1
  Ag  Ag90  1  0.253334  0.771485  0.467825  1
  Ag  Ag91  1  0.757724  0.232711  0.528481  1
  Ag  Ag92  1  0.751176  0.963359  0.502755  1
  Ag  Ag93  1  0.751475  0.502060  0.554043  1
  Ag  Ag94  1  0.751099  0.098833  0.515039  1
  Ag  Ag95  1  0.751090  0.637505  0.566454  1
  Ag  Ag96  1  0.758062  0.368114  0.540597  1
  Ag  Ag97  1  0.750885  0.003954  0.554240  1
  Ag  Ag98  1  0.752873  0.734568  0.528554  1
  Ag  Ag99  1  0.755159  0.465352  0.502747  1
  Ag  Ag100  1  0.251150  0.081065  0.544989  1
  Ag  Ag101  1  0.252875  0.811835  0.519296  1
  Ag  Ag102  1  0.258812  0.350267  0.570426  1
  Ag  Ag103  1  0.257884  0.214909  0.558320  1
  Ag  Ag104  1  0.250986  0.945562  0.532805  1
  Ag  Ag105  1  0.253112  0.676477  0.507068  1
  Ag  Ag106  1  0.257846  0.309980  0.519150  1
  Ag  Ag107  1  0.248171  0.848080  0.570679  1
  Ag  Ag108  1  0.251359  0.579503  0.545054  1
  Ag  Ag109  1  0.750324  0.040849  0.605745  1
  Ag  Ag110  1  0.748180  0.771226  0.579955  1
  Ag  Ag111  1  0.784094  0.309846  0.631270  1
  Ag  Ag112  1  0.748044  0.906910  0.592019  1
  Ag  Ag113  1  0.785237  0.444929  0.642613  1
  Ag  Ag114  1  0.751736  0.175639  0.617953  1
  Ag  Ag115  1  0.746975  0.812067  0.631234  1
  Ag  Ag116  1  0.751171  0.542430  0.605424  1
  Ag  Ag117  1  0.758753  0.272890  0.579940  1
  Ag  Ag118  1  0.247377  0.888508  0.621903  1
  Ag  Ag119  1  0.250623  0.619451  0.596674  1
  Ag  Ag120  1  0.252927  0.157223  0.647738  1
  Ag  Ag121  1  0.249387  0.022270  0.635067  1
  Ag  Ag122  1  0.247833  0.752759  0.610138  1
  Ag  Ag123  1  0.252040  0.484100  0.584150  1
  Ag  Ag124  1  0.250876  0.117989  0.596237  1
  Ag  Ag125  1  0.235172  0.654903  0.648480  1
  Ag  Ag126  1  0.284538  0.385876  0.621598  1
  Ag  Ag127  1  0.720111  0.848862  0.682347  1
  Ag  Ag128  1  0.736077  0.579379  0.656741  1
  Ag  Ag129  1  0.839922  0.111368  0.712287  1
  Ag  Ag130  1  0.733936  0.713966  0.668640  1
  Ag  Ag131  1  0.845286  0.251777  0.719218  1
  Ag  Ag132  1  0.717077  0.981880  0.695422  1
  Ag  Ag133  1  0.731622  0.618780  0.709598  1
  Ag  Ag134  1  0.795211  0.352230  0.683154  1
  Ag  Ag135  1  0.751216  0.081999  0.658349  1
  Ag  Ag136  1  0.231739  0.697388  0.700098  1
  Ag  Ag137  1  0.285518  0.426679  0.672378  1
  Ag  Ag138  1  0.214649  0.972956  0.724226  1
  Ag  Ag139  1  0.222282  0.834349  0.713919  1
  Ag  Ag140  1  0.230869  0.558586  0.689333  1
  Ag  Ag141  1  0.285232  0.289799  0.660926  1
  Ag  Ag142  1  0.218804  0.924466  0.673020  1
  Ag  Ag143  1  0.085109  0.431334  0.722405  1
  Ag  Ag144  1  0.342165  0.185702  0.699609  1
