# generated using pymatgen
data_Li6Zn3(PS4)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.30573804
_cell_length_b   11.60056549
_cell_length_c   23.15904896
_cell_angle_alpha   90.08348657
_cell_angle_beta   89.96613852
_cell_angle_gamma   89.99442243
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6Zn3(PS4)4
_chemical_formula_sum   'Li24 Zn12 P16 S64'
_cell_volume   2500.05846565
_cell_formula_units_Z   4
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
  Li  Li0  1  0.74894425  0.49762863  0.62747530  1
  Li  Li1  1  0.75188291  0.50524491  0.87422697  1
  Li  Li2  1  0.74735742  0.99433292  0.87958947  1
  Li  Li3  1  0.24516870  0.25194384  0.74700470  1
  Li  Li4  1  0.50178888  0.50012864  0.24943307  1
  Li  Li5  1  0.50569601  0.99817456  0.25100012  1
  Li  Li6  1  0.49701058  0.50050208  0.49650644  1
  Li  Li7  1  0.50214436  0.00222824  0.50048314  1
  Li  Li8  1  0.00100218  0.75111617  0.37451828  1
  Li  Li9  1  0.00406568  0.25234288  0.37305118  1
  Li  Li10  1  0.49431642  0.50353711  0.75101822  1
  Li  Li11  1  0.49803572  0.00016843  0.74681247  1
  Li  Li12  1  0.00166945  0.75370508  0.62390875  1
  Li  Li13  1  0.00130893  0.24836103  0.62266871  1
  Li  Li14  1  0.49016388  0.49787115  0.00371291  1
  Li  Li15  1  0.49482365  0.99710156  0.00108943  1
  Li  Li16  1  0.01724151  0.74788507  0.87573259  1
  Li  Li17  1  0.00208182  0.24787382  0.87774315  1
  Li  Li18  1  0.00295999  0.75086347  0.12613799  1
  Li  Li19  1  0.00290220  0.24883356  0.12504187  1
  Li  Li20  1  0.50021314  0.24771704  0.62272785  1
  Li  Li21  1  0.48315477  0.75148274  0.87508989  1
  Li  Li22  1  0.00644064  0.50179594  0.74961981  1
  Li  Li23  1  0.00731011  0.00119547  0.00270802  1
  Zn  Zn24  1  0.49828006  0.24891894  0.12660499  1
  Zn  Zn25  1  0.49898827  0.75035942  0.12414035  1
  Zn  Zn26  1  0.49968411  0.24994527  0.37491815  1
  Zn  Zn27  1  0.49921669  0.74912098  0.37391899  1
  Zn  Zn28  1  0.99816608  0.50001005  0.24979942  1
  Zn  Zn29  1  0.99990259  0.99899245  0.24943904  1
  Zn  Zn30  1  0.49171808  0.75053182  0.62625353  1
  Zn  Zn31  1  0.00570363  0.50044679  0.49866485  1
  Zn  Zn32  1  0.99931940  0.00001669  0.49910101  1
  Zn  Zn33  1  0.49263148  0.24969928  0.87659485  1
  Zn  Zn34  1  0.99844319  0.99942973  0.74901778  1
  Zn  Zn35  1  0.00391541  0.50003178  0.00076021  1
  P  P36  1  0.75061137  0.25013566  0.25000506  1
  P  P37  1  0.75013147  0.74971728  0.25002656  1
  P  P38  1  0.74891264  0.24646982  0.49943447  1
  P  P39  1  0.75163385  0.74909477  0.50015266  1
  P  P40  1  0.25021856  0.50070733  0.37439056  1
  P  P41  1  0.25042444  0.00025951  0.37527773  1
  P  P42  1  0.75259356  0.25406418  0.75336470  1
  P  P43  1  0.74721220  0.74601071  0.74776476  1
  P  P44  1  0.25347370  0.49615400  0.62222077  1
  P  P45  1  0.24604134  0.99977207  0.62707201  1
  P  P46  1  0.74821436  0.25154561  0.99771736  1
  P  P47  1  0.75028727  0.75276908  0.00166080  1
  P  P48  1  0.24720485  0.49998865  0.87730198  1
  P  P49  1  0.25232897  0.00037549  0.87123382  1
  P  P50  1  0.24953264  0.49928352  0.12576690  1
  P  P51  1  0.25186330  0.00417834  0.12668641  1
  S  S52  1  0.86324878  0.36066639  0.05033326  1
  S  S53  1  0.87146685  0.85458699  0.05208427  1
  S  S54  1  0.86396122  0.36213575  0.30233934  1
  S  S55  1  0.86326813  0.86176598  0.30242962  1
  S  S56  1  0.36511553  0.61093749  0.17722857  1
  S  S57  1  0.37393329  0.10904900  0.18002378  1
  S  S58  1  0.86874270  0.36196140  0.55141092  1
  S  S59  1  0.86359770  0.86127281  0.55218426  1
  S  S60  1  0.36201485  0.61352355  0.42671554  1
  S  S61  1  0.36449344  0.11183931  0.42756631  1
  S  S62  1  0.87562082  0.35804102  0.80484490  1
  S  S63  1  0.86939597  0.85603733  0.80104536  1
  S  S64  1  0.36131250  0.60923128  0.67707791  1
  S  S65  1  0.36541276  0.10972221  0.67723497  1
  S  S66  1  0.37506007  0.59865849  0.92719373  1
  S  S67  1  0.36151204  0.11158902  0.92648444  1
  S  S68  1  0.63683186  0.64479000  0.30607799  1
  S  S69  1  0.63685349  0.14633474  0.30616968  1
  S  S70  1  0.62911116  0.64530063  0.55580657  1
  S  S71  1  0.64179806  0.14359771  0.55444913  1
  S  S72  1  0.13724347  0.89510022  0.43123812  1
  S  S73  1  0.13806351  0.39516324  0.43026738  1
  S  S74  1  0.62964692  0.64704288  0.80360710  1
  S  S75  1  0.62714940  0.14583986  0.80535104  1
  S  S76  1  0.13125852  0.89335597  0.68128736  1
  S  S77  1  0.13073791  0.39425483  0.67655855  1
  S  S78  1  0.63029471  0.64497709  0.05371367  1
  S  S79  1  0.62898707  0.15003730  0.05231287  1
  S  S80  1  0.12903853  0.90418705  0.92440054  1
  S  S81  1  0.13184593  0.39166383  0.93110866  1
  S  S82  1  0.13933805  0.89663846  0.18230486  1
  S  S83  1  0.13410673  0.39580844  0.18138249  1
  S  S84  1  0.86465560  0.13859304  0.19791588  1
  S  S85  1  0.86442480  0.63836685  0.19788026  1
  S  S86  1  0.87503772  0.14389977  0.44715615  1
  S  S87  1  0.86398885  0.63739337  0.44790663  1
  S  S88  1  0.36552650  0.38933972  0.32263837  1
  S  S89  1  0.36530679  0.88900486  0.32310893  1
  S  S90  1  0.86533022  0.14400820  0.69961291  1
  S  S91  1  0.87287404  0.64330599  0.69643277  1
  S  S92  1  0.37491933  0.39464769  0.57102889  1
  S  S93  1  0.36303633  0.89081033  0.57432276  1
  S  S94  1  0.86584084  0.14133412  0.94723328  1
  S  S95  1  0.87040982  0.63979863  0.94761738  1
  S  S96  1  0.36461262  0.38642219  0.82232214  1
  S  S97  1  0.37174167  0.89874092  0.81934993  1
  S  S98  1  0.36106539  0.38521537  0.07423402  1
  S  S99  1  0.36313812  0.88957732  0.07412749  1
  S  S100  1  0.63787385  0.35464695  0.19398999  1
  S  S101  1  0.63541796  0.85276501  0.19438320  1
  S  S102  1  0.63788535  0.35344003  0.44386131  1
  S  S103  1  0.63238881  0.85100507  0.44581709  1
  S  S104  1  0.13450615  0.60412089  0.31910839  1
  S  S105  1  0.13554036  0.10319608  0.31954458  1
  S  S106  1  0.62732351  0.35303936  0.69967573  1
  S  S107  1  0.63224238  0.85359591  0.69436003  1
  S  S108  1  0.12938506  0.60329866  0.57074066  1
  S  S109  1  0.13320811  0.10218106  0.57021837  1
  S  S110  1  0.62622314  0.35937742  0.94385257  1
  S  S111  1  0.62956269  0.85176377  0.94584155  1
  S  S112  1  0.13625320  0.60101482  0.82196502  1
  S  S113  1  0.12718874  0.10937114  0.81752647  1
  S  S114  1  0.13690077  0.60417050  0.06983237  1
  S  S115  1  0.14138563  0.10738512  0.07257463  1
