# generated using pymatgen
data_SrU(PS4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.26350100
_cell_length_b   11.26350100
_cell_length_c   9.63642400
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrU(PS4)2
_chemical_formula_sum   'Sr4 U4 P8 S32'
_cell_volume   1222.53894961
_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
  Sr  Sr0  1  0.50000000  0.00000000  0.75000000  1.0
  Sr  Sr1  1  0.00000000  0.50000000  0.25000000  1.0
  Sr  Sr2  1  0.00000000  0.50000000  0.75000000  1.0
  Sr  Sr3  1  0.50000000  0.00000000  0.25000000  1.0
  U  U4  1  0.50000000  0.50000000  0.75000000  1.0
  U  U5  1  0.50000000  0.50000000  0.25000000  1.0
  U  U6  1  0.00000000  0.00000000  0.75000000  1.0
  U  U7  1  0.00000000  0.00000000  0.25000000  1.0
  P  P8  1  0.46423800  0.26319300  0.50000000  1.0
  P  P9  1  0.73680700  0.46423800  0.00000000  1.0
  P  P10  1  0.96423800  0.23680700  0.50000000  1.0
  P  P11  1  0.76319300  0.96423800  0.00000000  1.0
  P  P12  1  0.53576200  0.73680700  0.50000000  1.0
  P  P13  1  0.26319300  0.53576200  0.00000000  1.0
  P  P14  1  0.03576200  0.76319300  0.50000000  1.0
  P  P15  1  0.23680700  0.03576200  0.00000000  1.0
  S  S16  1  0.27236900  0.43248500  0.82367100  1.0
  S  S17  1  0.56751500  0.27236900  0.32367100  1.0
  S  S18  1  0.77236900  0.06751500  0.82367100  1.0
  S  S19  1  0.93248500  0.77236900  0.32367100  1.0
  S  S20  1  0.27236900  0.43248500  0.17632900  1.0
  S  S21  1  0.56751500  0.27236900  0.67632900  1.0
  S  S22  1  0.77236900  0.06751500  0.17632900  1.0
  S  S23  1  0.93248500  0.77236900  0.67632900  1.0
  S  S24  1  0.72763100  0.56751500  0.17632900  1.0
  S  S25  1  0.43248500  0.72763100  0.67632900  1.0
  S  S26  1  0.22763100  0.93248500  0.17632900  1.0
  S  S27  1  0.06751500  0.22763100  0.67632900  1.0
  S  S28  1  0.72763100  0.56751500  0.82367100  1.0
  S  S29  1  0.43248500  0.72763100  0.32367100  1.0
  S  S30  1  0.22763100  0.93248500  0.82367100  1.0
  S  S31  1  0.06751500  0.22763100  0.32367100  1.0
  S  S32  1  0.36814000  0.42037300  0.50000000  1.0
  S  S33  1  0.57962700  0.36814000  0.00000000  1.0
  S  S34  1  0.86814000  0.07962700  0.50000000  1.0
  S  S35  1  0.92037300  0.86814000  0.00000000  1.0
  S  S36  1  0.63186000  0.57962700  0.50000000  1.0
  S  S37  1  0.42037300  0.63186000  0.00000000  1.0
  S  S38  1  0.13186000  0.92037300  0.50000000  1.0
  S  S39  1  0.07962700  0.13186000  0.00000000  1.0
  S  S40  1  0.36745900  0.11266000  0.50000000  1.0
  S  S41  1  0.88734000  0.36745900  0.00000000  1.0
  S  S42  1  0.86745900  0.38734000  0.50000000  1.0
  S  S43  1  0.61266000  0.86745900  0.00000000  1.0
  S  S44  1  0.63254100  0.88734000  0.50000000  1.0
  S  S45  1  0.11266000  0.63254100  0.00000000  1.0
  S  S46  1  0.13254100  0.61266000  0.50000000  1.0
  S  S47  1  0.38734000  0.13254100  0.00000000  1.0