[CIF]
data_K3As(PSe3)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.29782400
_cell_length_b   23.86420300
_cell_length_c   12.45042449
_cell_angle_alpha   90.00000000
_cell_angle_beta   124.56717412
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   K3As(PSe3)3
_chemical_formula_sum   'K12 As4 P12 Se36'
_cell_volume   2030.19916230
_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
  K  K0  1  -4.25465940  19.88494261  7.38903010  1
  K  K1  1  1.95644890  7.95284111  7.98963890  1
  K  K2  1  5.48846040  3.97926039  2.86341590  1
  K  K3  1  -0.72264790  15.91136189  2.26280710  1
  K  K4  1  -0.06526266  16.48794490  7.65538865  1
  K  K5  1  -2.23294784  4.55584340  7.72328035  1
  K  K6  1  1.29906366  7.37625810  2.59705735  1
  K  K7  1  3.46674884  19.30835960  2.52916565  1
  K  K8  1  0.03059590  23.25012933  7.88736049  1
  K  K9  1  -2.32880640  11.31802783  7.49130851  1
  K  K10  1  1.20320510  0.61407367  2.36508551  1
  K  K11  1  3.56260740  12.54617517  2.76113749  1
  As  As12  1  -4.84730223  13.76181767  7.48311680  1
  As  As13  1  2.54909173  1.82971617  7.89555220  1
  As  As14  1  6.08110323  10.10238533  2.76932920  1
  As  As15  1  -1.31529073  22.03448683  2.35689380  1
  P  P16  1  -3.26885114  15.88628062  5.41743348  1
  P  P17  1  0.97064064  3.95417912  9.96123552  1
  P  P18  1  4.50265214  7.97792238  4.83501252  1
  P  P19  1  0.26316036  19.91002388  0.29121048  1
  P  P20  1  -3.08978023  0.65325869  5.95211904  1
  P  P21  1  0.79156973  12.58536019  9.42654996  1
  P  P22  1  4.32358123  23.21094431  4.30032696  1
  P  P23  1  0.44223127  11.27884281  0.82589604  1
  P  P24  1  -1.65000727  7.78044610  5.61557225  1
  P  P25  1  -0.64820323  19.71254760  9.76309675  1
  P  P26  1  2.88380827  16.08375690  4.63687375  1
  P  P27  1  1.88200423  4.15165540  0.48934925  1
  Se  Se28  1  -6.06709798  14.38987577  9.50327927  1
  Se  Se29  1  3.76888748  2.45777427  5.87538973  1
  Se  Se30  1  7.30089898  9.47432723  0.74916673  1
  Se  Se31  1  -2.53508648  21.40642873  4.37705627  1
  Se  Se32  1  -5.94312717  21.84063791  10.01532743  1
  Se  Se33  1  3.64491667  9.90853641  5.36334157  1
  Se  Se34  1  7.17692817  2.02356509  0.23711857  1
  Se  Se35  1  -2.41111567  13.95566659  4.88910443  1
  Se  Se36  1  -5.71873646  18.12820317  9.99016793  1
  Se  Se37  1  3.42052596  6.19610167  5.38850107  1
  Se  Se38  1  6.95253746  5.73599983  0.26227807  1
  Se  Se39  1  -2.18672496  17.66810133  4.86394493  1
  Se  Se40  1  -3.68533194  15.93711137  7.67143373  1
  Se  Se41  1  1.38712144  4.00500987  7.70723527  1
  Se  Se42  1  4.91913294  7.92709163  2.58101227  1
  Se  Se43  1  -0.15332044  19.85919313  2.54521073  1
  Se  Se44  1  -3.37642188  23.45746152  7.83035689  1
  Se  Se45  1  1.07821138  11.52536002  7.54831211  1
  Se  Se46  1  4.61022288  0.40674148  2.42208911  1
  Se  Se47  1  0.15558962  12.33884298  2.70413389  1
  Se  Se48  1  -1.14535836  1.41867914  5.40065022  1
  Se  Se49  1  -1.15285214  13.35078064  9.97801878  1
  Se  Se50  1  2.37915936  22.44552386  4.85179578  1
  Se  Se51  1  2.38665314  10.51342236  0.27442722  1
  Se  Se52  1  -0.63333666  19.99194969  7.61039067  1
  Se  Se53  1  -1.66487384  8.05984819  7.76827833  1
  Se  Se54  1  1.86713766  3.87225331  2.64205533  1
  Se  Se55  1  2.89867484  15.80435481  2.48416767  1
  Se  Se56  1  1.98599299  17.93416333  5.33115914  1
  Se  Se57  1  -4.28420349  6.00206183  10.04750986  1
  Se  Se58  1  -0.75219199  5.93003967  4.92128686  1
  Se  Se59  1  5.51800449  17.86214117  0.20493614  1
  Se  Se60  1  1.89190777  14.23280158  5.64133664  1
  Se  Se61  1  -4.19011827  2.30070008  9.73733236  1
  Se  Se62  1  -0.65810677  9.63140142  4.61110936  1
  Se  Se63  1  5.42391927  21.56350292  0.51511364  1
[/CIF]
