# generated using pymatgen
data_Li6Zn3(PS4)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.34976524
_cell_length_b   11.60542345
_cell_length_c   23.10993790
_cell_angle_alpha   89.95831016
_cell_angle_beta   89.96117996
_cell_angle_gamma   90.07831655
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6Zn3(PS4)4
_chemical_formula_sum   'Li24 Zn12 P16 S64'
_cell_volume   2507.60920491
_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  0.74224618  0.49665621  0.87736114  1
  Li  Li1  1  0.75030582  0.00617095  0.87246714  1
  Li  Li2  1  0.25118787  0.75753185  0.75280884  1
  Li  Li3  1  0.24477420  0.74167630  0.99611498  1
  Li  Li4  1  0.50602023  0.49791823  0.25034435  1
  Li  Li5  1  0.50491958  0.99767199  0.25182687  1
  Li  Li6  1  0.50133354  0.49987872  0.49961041  1
  Li  Li7  1  0.50541613  0.00202994  0.49874244  1
  Li  Li8  1  0.00279406  0.75015466  0.37493516  1
  Li  Li9  1  0.00113763  0.24976781  0.37467246  1
  Li  Li10  1  0.49695046  0.49787642  0.74789627  1
  Li  Li11  1  0.50269775  0.00441181  0.74890168  1
  Li  Li12  1  0.99837741  0.75174556  0.62276663  1
  Li  Li13  1  0.00323317  0.25039518  0.62421265  1
  Li  Li14  1  0.49457193  0.49620196  0.99970812  1
  Li  Li15  1  0.99228060  0.74861591  0.87517333  1
  Li  Li16  1  0.01239761  0.24938810  0.87498573  1
  Li  Li17  1  0.99815396  0.74949441  0.12771192  1
  Li  Li18  1  0.00314877  0.25045122  0.12477585  1
  Li  Li19  1  0.48227464  0.24870421  0.87432913  1
  Li  Li20  1  0.50240693  0.74922256  0.87567269  1
  Li  Li21  1  0.00286494  0.00305716  0.74920872  1
  Li  Li22  1  0.99292370  0.49855077  0.00266921  1
  Li  Li23  1  0.99997062  0.00274306  0.00038361  1
  Zn  Zn24  1  0.49742414  0.00161491  0.00186518  1
  Zn  Zn25  1  0.49600092  0.25120177  0.12440774  1
  Zn  Zn26  1  0.50925065  0.74786549  0.12716369  1
  Zn  Zn27  1  0.49921141  0.25024476  0.37483089  1
  Zn  Zn28  1  0.49792447  0.74975384  0.37513314  1
  Zn  Zn29  1  0.99967080  0.49996372  0.25032920  1
  Zn  Zn30  1  0.00078586  0.99959043  0.24936927  1
  Zn  Zn31  1  0.49978825  0.24910763  0.62613342  1
  Zn  Zn32  1  0.50688356  0.75177334  0.62308131  1
  Zn  Zn33  1  0.99874399  0.49945162  0.49956008  1
  Zn  Zn34  1  0.99956786  0.00023371  0.49975800  1
  Zn  Zn35  1  0.99898379  0.49968217  0.74987644  1
  P  P36  1  0.75083134  0.24899992  0.24952090  1
  P  P37  1  0.75135843  0.74964984  0.25064715  1
  P  P38  1  0.75002768  0.25062063  0.50001892  1
  P  P39  1  0.75089171  0.74981608  0.49931209  1
  P  P40  1  0.25000617  0.49979063  0.37506209  1
  P  P41  1  0.24984405  0.99995969  0.37483372  1
  P  P42  1  0.75040915  0.24804361  0.74812709  1
  P  P43  1  0.74967392  0.74407170  0.75192350  1
  P  P44  1  0.24770928  0.50099605  0.62512553  1
  P  P45  1  0.25437038  0.99435263  0.62390369  1
  P  P46  1  0.74804090  0.25154562  0.99697525  1
  P  P47  1  0.75021494  0.75536419  0.00223951  1
  P  P48  1  0.24787678  0.50124830  0.87427532  1
  P  P49  1  0.24954850  0.98970957  0.87647648  1
  P  P50  1  0.25336869  0.50632758  0.12619433  1
  P  P51  1  0.24872169  0.00755415  0.12552797  1
  S  S52  1  0.86046026  0.35117714  0.05233794  1
  S  S53  1  0.87046439  0.85641645  0.05395462  1
  S  S54  1  0.86437053  0.36072654  0.30185824  1
  S  S55  1  0.86728671  0.86073482  0.30223217  1
  S  S56  1  0.37112171  0.61318377  0.17953264  1
  S  S57  1  0.37478780  0.10801064  0.17813910  1
  S  S58  1  0.86420000  0.36208449  0.55214416  1
  S  S59  1  0.86198515  0.86262661  0.55160136  1
  S  S60  1  0.36364746  0.61119780  0.42742333  1
  S  S61  1  0.36413061  0.11140164  0.42690354  1
  S  S62  1  0.86809574  0.36007539  0.80235800  1
  S  S63  1  0.86728956  0.85575510  0.80215278  1
  S  S64  1  0.36829241  0.61390243  0.67611812  1
  S  S65  1  0.36372311  0.10831193  0.67648289  1
  S  S66  1  0.36803607  0.60841534  0.92682370  1
  S  S67  1  0.36715194  0.09750152  0.93021420  1
  S  S68  1  0.63558889  0.64663189  0.30641780  1
  S  S69  1  0.63664931  0.14604894  0.30609767  1
  S  S70  1  0.63935649  0.64408927  0.55536650  1
  S  S71  1  0.63503535  0.14721436  0.55577652  1
  S  S72  1  0.13525210  0.89613881  0.43068626  1
  S  S73  1  0.13595817  0.39545812  0.43094164  1
  S  S74  1  0.62767096  0.63922096  0.80377210  1
  S  S75  1  0.63049542  0.14862456  0.80363046  1
  S  S76  1  0.13428041  0.89228011  0.67800251  1
  S  S77  1  0.13726690  0.39653379  0.68135369  1
  S  S78  1  0.62371036  0.64835525  0.05251324  1
  S  S79  1  0.62847929  0.14291380  0.05324665  1
  S  S80  1  0.12796719  0.88558178  0.92969695  1
  S  S81  1  0.12061672  0.40434199  0.92593052  1
  S  S82  1  0.14032990  0.89714981  0.18022173  1
  S  S83  1  0.13652927  0.40072589  0.18064472  1
  S  S84  1  0.86530237  0.13771481  0.19749562  1
  S  S85  1  0.86219746  0.63690901  0.19839682  1
  S  S86  1  0.86442028  0.13919165  0.44793461  1
  S  S87  1  0.86624672  0.63918822  0.44730981  1
  S  S88  1  0.36429390  0.38879902  0.32278570  1
  S  S89  1  0.36329513  0.88780335  0.32283941  1
  S  S90  1  0.87128495  0.14599617  0.69720619  1
  S  S91  1  0.87034857  0.64106811  0.69777398  1
  S  S92  1  0.36618763  0.39141627  0.57409083  1
  S  S93  1  0.37305602  0.88840438  0.57062005  1
  S  S94  1  0.86551865  0.14296308  0.94541298  1
  S  S95  1  0.86042348  0.64547333  0.94840258  1
  S  S96  1  0.36645809  0.39933023  0.82191481  1
  S  S97  1  0.37690450  0.89113436  0.82264634  1
  S  S98  1  0.36296845  0.39228192  0.07372577  1
  S  S99  1  0.37008153  0.89008592  0.07328308  1
  S  S100  1  0.63745886  0.35249456  0.19327927  1
  S  S101  1  0.64034993  0.85575099  0.19472553  1
  S  S102  1  0.63598421  0.35423649  0.44389802  1
  S  S103  1  0.63592369  0.85309887  0.44355269  1
  S  S104  1  0.13557821  0.60384465  0.31948432  1
  S  S105  1  0.13609546  0.10372526  0.31881917  1
  S  S106  1  0.63151364  0.35478121  0.69505571  1
  S  S107  1  0.63232659  0.84913525  0.69705619  1
  S  S108  1  0.13447984  0.60439458  0.56909857  1
  S  S109  1  0.13745418  0.09946140  0.56933671  1
  S  S110  1  0.62147348  0.35281675  0.94520636  1
  S  S111  1  0.62786483  0.86287553  0.94824148  1
  S  S112  1  0.12716499  0.61041995  0.81889756  1
  S  S113  1  0.13321669  0.09664787  0.82553407  1
  S  S114  1  0.13303758  0.60807907  0.07226224  1
  S  S115  1  0.14133385  0.10881022  0.07018556  1
