# generated using pymatgen
data_Li6Zn3(PS4)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.33423933
_cell_length_b   11.59949761
_cell_length_c   23.15109579
_cell_angle_alpha   89.93078327
_cell_angle_beta   89.95455704
_cell_angle_gamma   90.00571902
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6Zn3(PS4)4
_chemical_formula_sum   'Li24 Zn12 P16 S64'
_cell_volume   2506.62408189
_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  0.25279252  0.25218044  0.50307035  1
  Li  Li1  1  0.75357564  0.49085162  0.87427923  1
  Li  Li2  1  0.74561782  0.00889003  0.87764900  1
  Li  Li3  1  0.25215323  0.25657489  0.75046100  1
  Li  Li4  1  0.50210204  0.49981721  0.24913974  1
  Li  Li5  1  0.50557188  0.99854762  0.25017685  1
  Li  Li6  1  0.51058948  0.50260723  0.49901620  1
  Li  Li7  1  0.50790287  0.99686235  0.50037154  1
  Li  Li8  1  0.00103859  0.75125050  0.37498892  1
  Li  Li9  1  0.99855142  0.25248183  0.37153238  1
  Li  Li10  1  0.50064841  0.50300232  0.74873443  1
  Li  Li11  1  0.49800011  0.00163621  0.74926602  1
  Li  Li12  1  0.99450556  0.74794268  0.62493616  1
  Li  Li13  1  0.98878892  0.25030800  0.62511578  1
  Li  Li14  1  0.49113977  0.49749105  0.00157175  1
  Li  Li15  1  0.49204575  0.00043491  0.00195719  1
  Li  Li16  1  0.00855374  0.74827360  0.87453301  1
  Li  Li17  1  0.01052293  0.24673251  0.87853934  1
  Li  Li18  1  0.00123074  0.75325833  0.12481810  1
  Li  Li19  1  0.00581652  0.24923425  0.12483116  1
  Li  Li20  1  0.51582348  0.25215126  0.62516531  1
  Li  Li21  1  0.49230279  0.25110235  0.87675128  1
  Li  Li22  1  0.99790872  0.49854545  0.74853554  1
  Li  Li23  1  0.00712061  0.00177311  0.00187076  1
  Zn  Zn24  1  0.49916355  0.24774716  0.12480465  1
  Zn  Zn25  1  0.49811384  0.75027342  0.12441701  1
  Zn  Zn26  1  0.50640090  0.25103893  0.37337255  1
  Zn  Zn27  1  0.49982864  0.74843540  0.37477496  1
  Zn  Zn28  1  0.99873974  0.49971784  0.24915799  1
  Zn  Zn29  1  0.99932696  0.99841344  0.24909233  1
  Zn  Zn30  1  0.49699093  0.74988482  0.62553539  1
  Zn  Zn31  1  0.99294708  0.50204459  0.50083012  1
  Zn  Zn32  1  0.99334176  0.99890398  0.49899875  1
  Zn  Zn33  1  0.48708508  0.75144545  0.87475071  1
  Zn  Zn34  1  0.99919712  0.00044758  0.74959342  1
  Zn  Zn35  1  0.00558282  0.49845527  0.00056840  1
  P  P36  1  0.75064750  0.25033027  0.24935329  1
  P  P37  1  0.75018331  0.74992380  0.25010520  1
  P  P38  1  0.75106884  0.24597740  0.49792631  1
  P  P39  1  0.74908295  0.75053962  0.49980971  1
  P  P40  1  0.25233556  0.49861561  0.37518240  1
  P  P41  1  0.24797495  0.00067060  0.37603969  1
  P  P42  1  0.75044894  0.24780027  0.75504090  1
  P  P43  1  0.74780014  0.75121486  0.74898115  1
  P  P44  1  0.25052946  0.49475858  0.62083872  1
  P  P45  1  0.24894505  0.00103989  0.62672926  1
  P  P46  1  0.74978655  0.25640501  0.99808810  1
  P  P47  1  0.74820643  0.74828681  0.00085067  1
  P  P48  1  0.24634630  0.50433173  0.87233828  1
  P  P49  1  0.25181695  0.99503786  0.87550246  1
  P  P50  1  0.24994607  0.50017639  0.12574824  1
  P  P51  1  0.25207242  0.00396969  0.12717314  1
  S  S52  1  0.87033076  0.36047856  0.05177170  1
  S  S53  1  0.86372287  0.85579816  0.05055418  1
  S  S54  1  0.86196743  0.36332532  0.30173369  1
  S  S55  1  0.86326900  0.86164109  0.30258067  1
  S  S56  1  0.36514444  0.61124177  0.17764735  1
  S  S57  1  0.37339384  0.10989769  0.17993035  1
  S  S58  1  0.86327838  0.35899310  0.55056553  1
  S  S59  1  0.86231919  0.86209929  0.55193797  1
  S  S60  1  0.36516679  0.60939968  0.42761692  1
  S  S61  1  0.37056985  0.11204736  0.42770241  1
  S  S62  1  0.87900504  0.35123577  0.80580089  1
  S  S63  1  0.86557069  0.86169356  0.80275278  1
  S  S64  1  0.36331244  0.60598463  0.67387831  1
  S  S65  1  0.36700230  0.11142139  0.67614913  1
  S  S66  1  0.36812598  0.60785245  0.92629426  1
  S  S67  1  0.36671799  0.10286052  0.92612652  1
  S  S68  1  0.63538783  0.64531863  0.30593688  1
  S  S69  1  0.63893389  0.14485459  0.30575540  1
  S  S70  1  0.63596369  0.64768938  0.55618180  1
  S  S71  1  0.63737440  0.14373943  0.55186465  1
  S  S72  1  0.13770000  0.89571437  0.43240959  1
  S  S73  1  0.12945433  0.39541855  0.43071228  1
  S  S74  1  0.63014232  0.64800745  0.80624336  1
  S  S75  1  0.62628812  0.14237411  0.80649926  1
  S  S76  1  0.12865641  0.89558816  0.67901861  1
  S  S77  1  0.13188980  0.39259496  0.67539268  1
  S  S78  1  0.62637998  0.64385944  0.05341323  1
  S  S79  1  0.63360708  0.15089394  0.05312349  1
  S  S80  1  0.12407540  0.89670498  0.92602359  1
  S  S81  1  0.13893006  0.39746300  0.93007990  1
  S  S82  1  0.13958135  0.89612087  0.18292900  1
  S  S83  1  0.13573743  0.39611234  0.18183504  1
  S  S84  1  0.86638845  0.13942119  0.19787823  1
  S  S85  1  0.86554606  0.63936835  0.19811552  1
  S  S86  1  0.87412354  0.14138251  0.44504437  1
  S  S87  1  0.86250642  0.63936000  0.44723040  1
  S  S88  1  0.36374579  0.38685761  0.32276014  1
  S  S89  1  0.36649686  0.89161024  0.32471000  1
  S  S90  1  0.86777571  0.14142539  0.70019602  1
  S  S91  1  0.86216665  0.64395958  0.69866839  1
  S  S92  1  0.37642356  0.39143581  0.56941795  1
  S  S93  1  0.36393822  0.89203214  0.57374252  1
  S  S94  1  0.86809137  0.14440087  0.94832569  1
  S  S95  1  0.86770049  0.63761418  0.94748226  1
  S  S96  1  0.36923483  0.39568104  0.82168570  1
  S  S97  1  0.36516689  0.88850200  0.81992260  1
  S  S98  1  0.36137866  0.38692835  0.07413727  1
  S  S99  1  0.36328765  0.88959086  0.07479634  1
  S  S100  1  0.63567142  0.35348442  0.19384716  1
  S  S101  1  0.63596693  0.85276552  0.19418885  1
  S  S102  1  0.63879922  0.35365731  0.44246010  1
  S  S103  1  0.63527647  0.85337881  0.44340448  1
  S  S104  1  0.13370593  0.60122385  0.32081287  1
  S  S105  1  0.13467708  0.10362365  0.32020697  1
  S  S106  1  0.63511455  0.35131104  0.70169008  1
  S  S107  1  0.62640226  0.85534016  0.69608002  1
  S  S108  1  0.13071827  0.60287586  0.56863455  1
  S  S109  1  0.12721363  0.10398721  0.56986716  1
  S  S110  1  0.62758452  0.36040941  0.94591525  1
  S  S111  1  0.62791274  0.85250882  0.94437230  1
  S  S112  1  0.12805042  0.60534163  0.81967406  1
  S  S113  1  0.13466061  0.10326410  0.81852029  1
  S  S114  1  0.13680701  0.60493510  0.06998181  1
  S  S115  1  0.14025337  0.10605952  0.07285742  1
