# generated using pymatgen
data_Li6Zn3(PS4)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.24388200
_cell_length_b   5.79605100
_cell_length_c   23.15063492
_cell_angle_alpha   89.93946365
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li6Zn3(PS4)4
_chemical_formula_sum   'Li12 Zn6 P8 S32'
_cell_volume   1240.36429198
_cell_formula_units_Z   2
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  0.25180800  0.24841600  0.56047100  1
  Li  Li1  1  0.75180800  0.75158400  0.43952900  1
  Li  Li2  1  0.99901900  0.74875900  0.81292800  1
  Li  Li3  1  0.99993200  0.74999800  0.06251400  1
  Li  Li4  1  0.49993200  0.25000200  0.93748600  1
  Li  Li5  1  0.00323000  0.75038800  0.31224400  1
  Li  Li6  1  0.49901900  0.25124100  0.18707200  1
  Li  Li7  1  0.99802300  0.75091700  0.56231100  1
  Li  Li8  1  0.49802300  0.24908300  0.43768900  1
  Li  Li9  1  0.50323000  0.24961200  0.68775600  1
  Li  Li10  1  0.00379800  0.25179700  0.43709400  1
  Li  Li11  1  0.50379800  0.74820300  0.56290600  1
  Zn  Zn12  1  0.99435300  0.24589200  0.68775900  1
  Zn  Zn13  1  0.00000200  0.24998100  0.93749300  1
  Zn  Zn14  1  0.50039600  0.75027200  0.81252600  1
  Zn  Zn15  1  0.00039600  0.24972800  0.18747400  1
  Zn  Zn16  1  0.50000200  0.75001900  0.06250700  1
  Zn  Zn17  1  0.49435300  0.75410800  0.31224100  1
  P  P18  1  0.25072300  0.75785600  0.68764000  1
  P  P19  1  0.24999600  0.74999100  0.93748800  1
  P  P20  1  0.74987300  0.24966100  0.81253700  1
  P  P21  1  0.24987300  0.75033900  0.18746300  1
  P  P22  1  0.74999600  0.25000900  0.06251200  1
  P  P23  1  0.24888900  0.74252000  0.43757400  1
  P  P24  1  0.75072300  0.24214400  0.31236000  1
  P  P25  1  0.74888900  0.25748000  0.56242600  1
  S  S26  1  0.36501600  0.54484100  0.74231700  1
  S  S27  1  0.36472900  0.54100700  0.99321800  1
  S  S28  1  0.86462800  0.04100000  0.86835300  1
  S  S29  1  0.36434300  0.54073200  0.24299800  1
  S  S30  1  0.86461500  0.04105000  0.11826300  1
  S  S31  1  0.37380100  0.53865000  0.49106800  1
  S  S32  1  0.86910500  0.03931600  0.36663200  1
  S  S33  1  0.87070100  0.04249500  0.61563000  1
  S  S34  1  0.13541900  0.52717700  0.88523500  1
  S  S35  1  0.13511700  0.52745000  0.13523500  1
  S  S36  1  0.63536800  0.02731900  0.01022500  1
  S  S37  1  0.12960700  0.53929000  0.38524100  1
  S  S38  1  0.63015500  0.03045500  0.25987200  1
  S  S39  1  0.13034400  0.53084300  0.63586300  1
  S  S40  1  0.63126100  0.03748900  0.51019500  1
  S  S41  1  0.63574700  0.02697600  0.76032000  1
  S  S42  1  0.36910500  0.96068400  0.63336800  1
  S  S43  1  0.36461500  0.95895000  0.88173700  1
  S  S44  1  0.86434300  0.45926800  0.75700200  1
  S  S45  1  0.36462800  0.95900000  0.13164700  1
  S  S46  1  0.86472900  0.45899300  0.00678200  1
  S  S47  1  0.37070100  0.95750500  0.38437000  1
  S  S48  1  0.86501600  0.45515900  0.25768300  1
  S  S49  1  0.87380100  0.46135000  0.50893200  1
  S  S50  1  0.13015500  0.96954500  0.74012800  1
  S  S51  1  0.13536800  0.97268100  0.98977500  1
  S  S52  1  0.63511700  0.47255000  0.86476500  1
  S  S53  1  0.13574700  0.97302400  0.23968000  1
  S  S54  1  0.63541900  0.47282300  0.11476500  1
  S  S55  1  0.13126100  0.96251100  0.48980500  1
  S  S56  1  0.63034400  0.46915700  0.36413700  1
  S  S57  1  0.62960700  0.46071000  0.61475900  1
