# generated using pymatgen
data_Li6Zn3(PS4)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.31692267
_cell_length_b   11.59590053
_cell_length_c   23.18249360
_cell_angle_alpha   90.07790091
_cell_angle_beta   89.96724761
_cell_angle_gamma   90.01559472
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6Zn3(PS4)4
_chemical_formula_sum   'Li24 Zn12 P16 S64'
_cell_volume   2504.58994280
_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  0.25224368  0.25217104  0.50223041  1
  Li  Li1  1  0.75191837  0.50363305  0.87302883  1
  Li  Li2  1  0.74772217  0.99612854  0.87786202  1
  Li  Li3  1  0.24858017  0.25238216  0.74923067  1
  Li  Li4  1  0.50102755  0.50063471  0.24905654  1
  Li  Li5  1  0.50271110  0.99918280  0.24969125  1
  Li  Li6  1  0.50606872  0.50258897  0.49970189  1
  Li  Li7  1  0.50661013  0.99741696  0.50055552  1
  Li  Li8  1  0.99966842  0.75062771  0.37483154  1
  Li  Li9  1  0.99748710  0.25125588  0.37244724  1
  Li  Li10  1  0.50287144  0.50340070  0.74955895  1
  Li  Li11  1  0.49699207  0.99924121  0.74814748  1
  Li  Li12  1  0.99683919  0.74962010  0.62461238  1
  Li  Li13  1  0.99095998  0.25050100  0.62553907  1
  Li  Li14  1  0.49181273  0.49969423  0.00219418  1
  Li  Li15  1  0.49636505  0.99800621  0.00085693  1
  Li  Li16  1  0.01427966  0.74912659  0.87497735  1
  Li  Li17  1  0.00148200  0.24858119  0.87728881  1
  Li  Li18  1  0.00141872  0.75092655  0.12535810  1
  Li  Li19  1  0.00300342  0.24907981  0.12436592  1
  Li  Li20  1  0.51045200  0.25134982  0.62471190  1
  Li  Li21  1  0.48768016  0.75089470  0.87504482  1
  Li  Li22  1  0.99898646  0.50175074  0.74894215  1
  Li  Li23  1  0.00548309  0.99986418  0.00182857  1
  Zn  Zn24  1  0.49796840  0.24857837  0.12536858  1
  Zn  Zn25  1  0.49911902  0.75021078  0.12373303  1
  Zn  Zn26  1  0.50619850  0.25145753  0.37374569  1
  Zn  Zn27  1  0.50068538  0.74919441  0.37484825  1
  Zn  Zn28  1  0.99907380  0.49925510  0.24907362  1
  Zn  Zn29  1  0.99949975  0.99831854  0.24868971  1
  Zn  Zn30  1  0.49965941  0.74992081  0.62621711  1
  Zn  Zn31  1  0.99409288  0.50232705  0.50127523  1
  Zn  Zn32  1  0.99341979  0.99869598  0.49920600  1
  Zn  Zn33  1  0.49295159  0.24877292  0.87613935  1
  Zn  Zn34  1  0.99904711  0.99964156  0.74994737  1
  Zn  Zn35  1  0.00409663  0.49947856  0.99999172  1
  P  P36  1  0.75039353  0.25021805  0.24959569  1
  P  P37  1  0.74991244  0.75011890  0.25011004  1
  P  P38  1  0.75020284  0.24625403  0.49883292  1
  P  P39  1  0.74923305  0.75018316  0.49991390  1
  P  P40  1  0.25257194  0.49922344  0.37506559  1
  P  P41  1  0.24725952  0.00046011  0.37563028  1
  P  P42  1  0.75016895  0.25228079  0.75373856  1
  P  P43  1  0.74990249  0.74679804  0.74832298  1
  P  P44  1  0.25036464  0.49531709  0.62188908  1
  P  P45  1  0.24968856  0.00061924  0.62673652  1
  P  P46  1  0.74921166  0.25144104  0.99797016  1
  P  P47  1  0.75027745  0.75311954  0.00172995  1
  P  P48  1  0.24684006  0.50138007  0.87689563  1
  P  P49  1  0.25303472  0.99879972  0.87218780  1
  P  P50  1  0.24994076  0.49986938  0.12543311  1
  P  P51  1  0.25089060  0.00406901  0.12616391  1
  S  S52  1  0.86394249  0.36109611  0.05049639  1
  S  S53  1  0.87038468  0.85548157  0.05255002  1
  S  S54  1  0.86312921  0.36261570  0.30195254  1
  S  S55  1  0.86401182  0.86178881  0.30243354  1
  S  S56  1  0.36463945  0.61164435  0.17722825  1
  S  S57  1  0.37145230  0.11041330  0.17935807  1
  S  S58  1  0.86453414  0.35898927  0.55110870  1
  S  S59  1  0.86288675  0.86178936  0.55207673  1
  S  S60  1  0.36520419  0.61025509  0.42754514  1
  S  S61  1  0.37012800  0.11183684  0.42749691  1
  S  S62  1  0.87520603  0.35569419  0.80513433  1
  S  S63  1  0.86844413  0.85966880  0.80223659  1
  S  S64  1  0.36436979  0.60625814  0.67466866  1
  S  S65  1  0.36778848  0.11108742  0.67635557  1
  S  S66  1  0.37202545  0.60146794  0.92735712  1
  S  S67  1  0.36247831  0.11094668  0.92681000  1
  S  S68  1  0.63551682  0.64549623  0.30602495  1
  S  S69  1  0.63770795  0.14506209  0.30570604  1
  S  S70  1  0.63544474  0.64720971  0.55585787  1
  S  S71  1  0.63641481  0.14409156  0.55262704  1
  S  S72  1  0.13650857  0.89581791  0.43187807  1
  S  S73  1  0.12968138  0.39597857  0.43061156  1
  S  S74  1  0.63139078  0.64796426  0.80439366  1
  S  S75  1  0.62719007  0.14288019  0.80664862  1
  S  S76  1  0.12896427  0.89619667  0.67910937  1
  S  S77  1  0.13187102  0.39343358  0.67665145  1
  S  S78  1  0.63050879  0.64507774  0.05396540  1
  S  S79  1  0.63191625  0.14899507  0.05315169  1
  S  S80  1  0.13120268  0.90184973  0.92562622  1
  S  S81  1  0.13218337  0.39204766  0.93062723  1
  S  S82  1  0.13915399  0.89626966  0.18211429  1
  S  S83  1  0.13543620  0.39543365  0.18123045  1
  S  S84  1  0.86532512  0.13904126  0.19784717  1
  S  S85  1  0.86488686  0.63867363  0.19828453  1
  S  S86  1  0.87243657  0.14097207  0.44576780  1
  S  S87  1  0.86321354  0.63889396  0.44746260  1
  S  S88  1  0.36436836  0.38717519  0.32284783  1
  S  S89  1  0.36601156  0.89116111  0.32444626  1
  S  S90  1  0.86416997  0.14111192  0.70054027  1
  S  S91  1  0.86889940  0.64454095  0.69702937  1
  S  S92  1  0.37423389  0.39104950  0.57001625  1
  S  S93  1  0.36462569  0.89120271  0.57399951  1
  S  S94  1  0.86691701  0.14171831  0.94748352  1
  S  S95  1  0.86964717  0.63992299  0.94797449  1
  S  S96  1  0.36779316  0.38881923  0.82258338  1
  S  S97  1  0.37068552  0.89649995  0.81993738  1
  S  S98  1  0.36282074  0.38699386  0.07385497  1
  S  S99  1  0.36364314  0.89002505  0.07410754  1
  S  S100  1  0.63598328  0.35386215  0.19413303  1
  S  S101  1  0.63514005  0.85287293  0.19452695  1
  S  S102  1  0.63714495  0.35387090  0.44364628  1
  S  S103  1  0.63585594  0.85375861  0.44376549  1
  S  S104  1  0.13414297  0.60149718  0.32060457  1
  S  S105  1  0.13453600  0.10393789  0.32000033  1
  S  S106  1  0.63246329  0.35213021  0.70034298  1
  S  S107  1  0.63088323  0.85456978  0.69566818  1
  S  S108  1  0.13144072  0.60320203  0.56938227  1
  S  S109  1  0.12830577  0.10400526  0.56999035  1
  S  S110  1  0.62621137  0.35798540  0.94427473  1
  S  S111  1  0.63070990  0.85269302  0.94609803  1
  S  S112  1  0.13384670  0.60051742  0.82137259  1
  S  S113  1  0.12879735  0.10835897  0.81849360  1
  S  S114  1  0.13587499  0.60382896  0.06988952  1
  S  S115  1  0.13889798  0.10621068  0.07208443  1
