# generated using pymatgen
data_Li4Zn(PS4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.37771100
_cell_length_b   8.01188035
_cell_length_c   18.41846429
_cell_angle_alpha   89.91432011
_cell_angle_beta   89.92984257
_cell_angle_gamma   89.80935175
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Zn(PS4)2
_chemical_formula_sum   'Li12 Zn3 P6 S24'
_cell_volume   941.12973334
_cell_formula_units_Z   3
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  0.68936700  0.24222700  0.66763200  1
  Li  Li1  1  0.69000100  0.25286300  0.33873800  1
  Li  Li2  1  0.68992500  0.24879600  0.99659800  1
  Li  Li3  1  0.30240800  0.26741600  0.50058500  1
  Li  Li4  1  0.31107500  0.25559000  0.16912200  1
  Li  Li5  1  0.69280700  0.76536600  0.99732400  1
  Li  Li6  1  0.30371000  0.74378700  0.83597300  1
  Li  Li7  1  0.30289100  0.73668400  0.50209400  1
  Li  Li8  1  0.30918600  0.74061600  0.16540100  1
  Li  Li9  1  0.85675100  0.00956600  0.50649700  1
  Li  Li10  1  0.85189100  0.00990300  0.17225600  1
  Li  Li11  1  0.14300000  0.50162000  0.00769900  1
  Zn  Zn12  1  0.29983200  0.24700600  0.83149900  1
  Zn  Zn13  1  0.69487100  0.74804300  0.66818700  1
  Zn  Zn14  1  0.69018400  0.74621200  0.33506700  1
  P  P15  1  0.18963800  0.99196700  0.66673400  1
  P  P16  1  0.19704600  0.99446200  0.33342700  1
  P  P17  1  0.17999500  0.00811400  0.99957700  1
  P  P18  1  0.79942500  0.49996500  0.83050900  1
  P  P19  1  0.82752400  0.50397600  0.50331400  1
  P  P20  1  0.82562400  0.49811000  0.16862900  1
  S  S21  1  0.31273500  0.21451500  0.70328300  1
  S  S22  1  0.31733400  0.20933100  0.37046500  1
  S  S23  1  0.32812200  0.21888500  0.03631500  1
  S  S24  1  0.66254700  0.27904900  0.86405000  1
  S  S25  1  0.67016600  0.29142600  0.53519700  1
  S  S26  1  0.67416100  0.28945100  0.20682900  1
  S  S27  1  0.33415000  0.77774700  0.70355000  1
  S  S28  1  0.33120200  0.77431300  0.36989400  1
  S  S29  1  0.32588200  0.79171000  0.03363100  1
  S  S30  1  0.67680000  0.71490200  0.86695400  1
  S  S31  1  0.67240200  0.72189300  0.53855900  1
  S  S32  1  0.67572700  0.71763800  0.20631100  1
  S  S33  1  0.17123900  0.00406400  0.88692700  1
  S  S34  1  0.21457500  0.00167500  0.55528300  1
  S  S35  1  0.20458000  0.99471400  0.22172700  1
  S  S36  1  0.81998100  0.49810700  0.71847500  1
  S  S37  1  0.83026500  0.50763600  0.39030300  1
  S  S38  1  0.78843700  0.50713500  0.05704600  1
  S  S39  1  0.88320500  0.98723900  0.70420400  1
  S  S40  1  0.88126800  0.98918600  0.36963600  1
  S  S41  1  0.87761700  0.00777600  0.03863600  1
  S  S42  1  0.11047800  0.48737600  0.87086200  1
  S  S43  1  0.11528500  0.50232900  0.54750800  1
  S  S44  1  0.12335000  0.49961400  0.20431600  1
