#------------------------------------------------------------------------------
#$Date: 2016-03-23 14:47:32 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179306 $
#$URL: svn://www.crystallography.net/cod/cif/4/32/03/4320325.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_4320325
loop_
_publ_author_name
'Franck Gascoin'
'Slavi C. Sevov'
_publ_section_title
;
 Synthesis and Characterization of the "Metallic Salts" A5Pn4 (A = K, Rb,
 Cs and Pn = As, Sb, Bi) with Isolated Zigzag Tetramers of Pn44- and an
 Extra Delocalized Electron
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              5177
_journal_page_last               5181
_journal_paper_doi               10.1021/ic0104499
_journal_volume                  40
_journal_year                    2001
_chemical_formula_moiety         K5As4
_chemical_formula_sum            'As4 K5'
_chemical_formula_weight         495.18
_chemical_melting_point          ?
_chemical_name_common            K5As4
_chemical_name_systematic
;
   ?
;
_space_group_IT_number           12
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 113.421(16)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   11.592(2)
_cell_length_b                   5.2114(5)
_cell_length_c                   10.383(3)
_cell_measurement_reflns_used    25
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      16.29
_cell_measurement_theta_min      11.78
_cell_volume                     575.6(2)
_computing_cell_refinement       CAD4_(Enraf-Nonius,_1977)
_computing_data_collection       CAD4_(Enraf-Nonius,_1977)
_computing_data_reduction        SDS_Package_(Enraf-Nonius,_1985)
_computing_molecular_graphics    'SHELXTL (Siemens, 1994)'
_computing_publication_material  'SHELXTL (Siemens, 1994)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measurement_device_type  Enraf_Nonius_CAD4
_diffrn_measurement_method       omega-2theta
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       6
_diffrn_reflns_limit_k_min       0
_diffrn_reflns_limit_l_max       12
_diffrn_reflns_limit_l_min       0
_diffrn_reflns_number            569
_diffrn_reflns_theta_full        24.93
_diffrn_reflns_theta_max         24.93
_diffrn_reflns_theta_min         2.14
_diffrn_standards_interval_count 200
_diffrn_standards_interval_time  120
_diffrn_standards_number         3
_exptl_absorpt_coefficient_mu    13.249
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.6678
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_process_details   Xabs
_exptl_crystal_colour            'gray, metallic luster'
_exptl_crystal_density_diffrn    2.857
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       irregular
_exptl_crystal_F_000             454
_exptl_crystal_size_max          0.24
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.20
_refine_diff_density_max         0.735
_refine_diff_density_min         -0.744
_refine_diff_density_rms         0.158
_refine_ls_extinction_coef       0.0009(5)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   1.005
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     32
_refine_ls_number_reflns         569
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.005
_refine_ls_R_factor_all          0.0514
_refine_ls_R_factor_gt           0.0322
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0422P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0728
_refine_ls_wR_factor_ref         0.0812
_reflns_number_gt                443
_reflns_number_total             569
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic0104499_1.cif
_cod_data_source_block           K5As4
_cod_depositor_comments
;
The following automatic conversions were performed:

'_chemical_melting_point' value 'not measured' was changed to '?' -
the value is undefined or not given.

Automatic conversion script
Id: cif_fix_values 1646 2011-03-28 12:23:43Z adriana 

The following automatic conversions were performed:

'_exptl_crystal_density_meas' value 'not measured' was changed to '?'
- the value is perceived as not measured.

Automatic conversion script
Id: cif_fix_values 3008 2015-01-20 13:52:24Z robertas 
;
_cod_database_code               4320325
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y, -z'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z'
'-x, -y, -z'
'x, -y, z'
'-x+1/2, -y+1/2, -z'
'x+1/2, -y+1/2, z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
As1 As 0.09602(8) 0.0000 0.10741(9) 0.0202(3) Uani 1 2 d S . .
As2 As 0.04276(8) 0.0000 0.31080(9) 0.0221(3) Uani 1 2 d S . .
K1 K 0.39063(19) 0.0000 0.0996(2) 0.0242(5) Uani 1 2 d S . .
K2 K 0.24648(19) 0.5000 0.3324(2) 0.0300(5) Uani 1 2 d S . .
K3 K 0.0237(18) 0.5000 0.518(2) 0.047(4) Uani 0.50 2 d SP . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
K K 0.2009 0.2494 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
As As 0.0499 2.0058 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
As2 As1 As1 109.86(6) . 5 ?
As2 As1 K1 129.66(3) . 7_545 ?
As1 As1 K1 71.28(4) 5 7_545 ?
As2 As1 K1 129.66(3) . 7 ?
As1 As1 K1 71.28(4) 5 7 ?
K1 As1 K1 99.25(6) 7_545 7 ?
As2 As1 K1 128.17(5) . . ?
As1 As1 K1 121.98(6) 5 . ?
K1 As1 K1 72.10(4) 7_545 . ?
K1 As1 K1 72.10(4) 7 . ?
As2 As1 K2 69.37(4) . . ?
As1 As1 K2 130.19(3) 5 . ?
K1 As1 K2 149.16(5) 7_545 . ?
K1 As1 K2 73.43(5) 7 . ?
K1 As1 K2 77.20(5) . . ?
As2 As1 K2 69.37(4) . 1_545 ?
As1 As1 K2 130.19(3) 5 1_545 ?
K1 As1 K2 73.43(5) 7_545 1_545 ?
K1 As1 K2 149.16(5) 7 1_545 ?
K1 As1 K2 77.19(5) . 1_545 ?
K2 As1 K2 97.29(6) . 1_545 ?
As2 As1 K1 67.33(4) . 3_445 ?
As1 As1 K1 67.40(4) 5 3_445 ?
K1 As1 K1 67.64(6) 7_545 3_445 ?
K1 As1 K1 138.68(3) 7 3_445 ?
K1 As1 K1 131.97(3) . 3_445 ?
K2 As1 K1 136.70(5) . 3_445 ?
K2 As1 K1 67.23(4) 1_545 3_445 ?
As2 As1 K1 67.33(4) . 3_455 ?
As1 As1 K1 67.40(4) 5 3_455 ?
K1 As1 K1 138.68(3) 7_545 3_455 ?
K1 As1 K1 67.64(6) 7 3_455 ?
K1 As1 K1 131.97(3) . 3_455 ?
K2 As1 K1 67.23(4) . 3_455 ?
K2 As1 K1 136.70(5) 1_545 3_455 ?
K1 As1 K1 95.91(6) 3_445 3_455 ?
As1 As2 K3 130.3(4) . . ?
As1 As2 K3 130.3(4) . 1_545 ?
K3 As2 K3 98.4(7) . 1_545 ?
As1 As2 K1 71.68(4) . 3_445 ?
K3 As2 K1 146.6(4) . 3_445 ?
K3 As2 K1 71.2(3) 1_545 3_445 ?
As1 As2 K1 71.68(4) . 3_455 ?
K3 As2 K1 71.2(3) . 3_455 ?
K3 As2 K1 146.6(4) 1_545 3_455 ?
K1 As2 K1 99.63(6) 3_445 3_455 ?
As1 As2 K2 69.71(4) . . ?
K3 As2 K2 66.5(4) . . ?
K3 As2 K2 137.8(2) 1_545 . ?
K1 As2 K2 141.39(6) 3_445 . ?
K1 As2 K2 68.40(4) 3_455 . ?
As1 As2 K2 69.71(4) . 1_545 ?
K3 As2 K2 137.8(2) . 1_545 ?
K3 As2 K2 66.5(4) 1_545 1_545 ?
K1 As2 K2 68.40(4) 3_445 1_545 ?
K1 As2 K2 141.39(6) 3_455 1_545 ?
K2 As2 K2 97.58(6) . 1_545 ?
As1 As2 K3 130.0(4) . 5_566 ?
K3 As2 K3 8.8(5) . 5_566 ?
K3 As2 K3 99.71(4) 1_545 5_566 ?
K1 As2 K3 138.8(3) 3_445 5_566 ?
K1 As2 K3 65.5(3) 3_455 5_566 ?
K2 As2 K3 71.4(4) . 5_566 ?
K2 As2 K3 146.1(2) 1_545 5_566 ?
As1 As2 K3 130.0(4) . 5_556 ?
K3 As2 K3 99.71(4) . 5_556 ?
K3 As2 K3 8.8(5) 1_545 5_556 ?
K1 As2 K3 65.5(3) 3_445 5_556 ?
K1 As2 K3 138.8(3) 3_455 5_556 ?
K2 As2 K3 146.1(2) . 5_556 ?
K2 As2 K3 71.4(4) 1_545 5_556 ?
K3 As2 K3 99.6(8) 5_566 5_556 ?
As1 As2 K2 130.28(5) . 3_445 ?
K3 As2 K2 69.8(4) . 3_445 ?
K3 As2 K2 69.8(4) 1_545 3_445 ?
K1 As2 K2 76.90(5) 3_445 3_445 ?
K1 As2 K2 76.90(5) 3_455 3_445 ?
K2 As2 K2 130.66(3) . 3_445 ?
K2 As2 K2 130.66(3) 1_545 3_445 ?
K3 As2 K2 62.6(4) 5_566 3_445 ?
K3 As2 K2 62.6(4) 5_556 3_445 ?
As1 As2 K2 127.13(5) . 7_556 ?
K3 As2 K2 62.3(2) . 7_556 ?
K3 As2 K2 62.3(2) 1_545 7_556 ?
K1 As2 K2 129.72(3) 3_445 7_556 ?
K1 As2 K2 129.72(3) 3_455 7_556 ?
K2 As2 K2 76.28(5) . 7_556 ?
K2 As2 K2 76.28(5) 1_545 7_556 ?
K3 As2 K2 70.1(2) 5_566 7_556 ?
K3 As2 K2 70.1(2) 5_556 7_556 ?
K2 As2 K2 102.60(5) 3_445 7_556 ?
As2 K1 As2 99.63(6) 3 3_545 ?
As2 K1 As1 147.67(7) 3 7_545 ?
As2 K1 As1 71.40(3) 3_545 7_545 ?
As2 K1 As1 71.40(3) 3 7 ?
As2 K1 As1 147.67(7) 3_545 7 ?
As1 K1 As1 99.25(6) 7_545 7 ?
As2 K1 As1 104.41(5) 3 . ?
As2 K1 As1 104.41(5) 3_545 . ?
As1 K1 As1 107.90(4) 7_545 . ?
As1 K1 As1 107.90(4) 7 . ?
As2 K1 As1 40.99(3) 3 3 ?
As2 K1 As1 112.32(6) 3_545 3 ?
As1 K1 As1 112.36(6) 7_545 3 ?
As1 K1 As1 41.32(3) 7 3 ?
As1 K1 As1 131.97(3) . 3 ?
As2 K1 As1 112.32(6) 3 3_545 ?
As2 K1 As1 40.99(3) 3_545 3_545 ?
As1 K1 As1 41.32(3) 7_545 3_545 ?
As1 K1 As1 112.36(6) 7 3_545 ?
As1 K1 As1 131.97(3) . 3_545 ?
As1 K1 As1 95.91(6) 3 3_545 ?
As2 K1 K3 57.25(16) 3 7_556 ?
As2 K1 K3 57.25(16) 3_545 7_556 ?
As1 K1 K3 128.04(10) 7_545 7_556 ?
As1 K1 K3 128.04(10) 7 7_556 ?
As1 K1 K3 79.6(4) . 7_556 ?
As1 K1 K3 94.9(2) 3 7_556 ?
As1 K1 K3 94.9(2) 3_545 7_556 ?
As2 K1 K3 54.75(14) 3 3_545 ?
As2 K1 K3 54.75(14) 3_545 3_545 ?
As1 K1 K3 126.13(13) 7_545 3_545 ?
As1 K1 K3 126.13(13) 7 3_545 ?
As1 K1 K3 86.1(4) . 3_545 ?
As1 K1 K3 90.6(3) 3 3_545 ?
As1 K1 K3 90.6(3) 3_545 3_545 ?
K3 K1 K3 6.5(7) 7_556 3_545 ?
As2 K1 K1 93.59(6) 3 5_655 ?
As2 K1 K1 93.59(6) 3_545 5_655 ?
As1 K1 K1 57.27(4) 7_545 5_655 ?
As1 K1 K1 57.27(4) 7 5_655 ?
As1 K1 K1 151.75(9) . 5_655 ?
As1 K1 K1 55.09(4) 3 5_655 ?
As1 K1 K1 55.09(4) 3_545 5_655 ?
K3 K1 K1 128.6(4) 7_556 5_655 ?
K3 K1 K1 122.1(4) 3_545 5_655 ?
As2 K1 K2 56.45(4) 3 3_545 ?
As2 K1 K2 56.45(4) 3_545 3_545 ?
As1 K1 K2 95.13(5) 7_545 3_545 ?
As1 K1 K2 95.13(5) 7 3_545 ?
As1 K1 K2 143.75(7) . 3_545 ?
As1 K1 K2 55.92(4) 3 3_545 ?
As1 K1 K2 55.92(4) 3_545 3_545 ?
K3 K1 K2 64.1(4) 7_556 3_545 ?
K3 K1 K2 57.6(4) 3_545 3_545 ?
K1 K1 K2 64.50(7) 5_655 3_545 ?
As2 K1 K1 158.02(9) 3 7_545 ?
As2 K1 K1 86.69(3) 3_545 7_545 ?
As1 K1 K1 54.27(3) 7_545 7_545 ?
As1 K1 K1 113.47(8) 7 7_545 ?
As1 K1 K1 53.63(5) . 7_545 ?
As1 K1 K1 153.18(9) 3 7_545 ?
As1 K1 K1 86.27(3) 3_545 7_545 ?
K3 K1 K1 111.6(3) 7_556 7_545 ?
K3 K1 K1 116.2(3) 3_545 7_545 ?
K1 K1 K1 107.10(8) 5_655 7_545 ?
K2 K1 K1 139.77(4) 3_545 7_545 ?
As2 K2 As2 97.58(6) 1_565 . ?
As2 K2 As1 40.92(3) 1_565 1_565 ?
As2 K2 As1 111.96(6) . 1_565 ?
As2 K2 As1 111.96(6) 1_565 . ?
As2 K2 As1 40.92(3) . . ?
As1 K2 As1 97.30(6) 1_565 . ?
As2 K2 As2 130.66(3) 1_565 3 ?
As2 K2 As2 130.66(3) . 3 ?
As1 K2 As2 101.45(5) 1_565 3 ?
As1 K2 As2 101.45(5) . 3 ?
As2 K2 As2 103.72(5) 1_565 7_556 ?
As2 K2 As2 103.72(5) . 7_556 ?
As1 K2 As2 131.17(3) 1_565 7_556 ?
As1 K2 As2 131.17(3) . 7_556 ?
As2 K2 As2 77.40(5) 3 7_556 ?
As2 K2 K3 81.5(3) 1_565 7_566 ?
As2 K2 K3 159.9(4) . 7_566 ?
As1 K2 K3 80.52(18) 1_565 7_566 ?
As1 K2 K3 156.9(5) . 7_566 ?
As2 K2 K3 57.1(4) 3 7_566 ?
As2 K2 K3 57.6(3) 7_556 7_566 ?
As2 K2 K3 159.9(4) 1_565 7_556 ?
As2 K2 K3 81.5(3) . 7_556 ?
As1 K2 K3 156.9(5) 1_565 7_556 ?
As1 K2 K3 80.52(18) . 7_556 ?
As2 K2 K3 57.1(4) 3 7_556 ?
As2 K2 K3 57.6(3) 7_556 7_556 ?
K3 K2 K3 92.5(4) 7_566 7_556 ?
As2 K2 K3 56.46(10) 1_565 . ?
As2 K2 K3 56.46(10) . . ?
As1 K2 K3 94.62(15) 1_565 . ?
As1 K2 K3 94.62(15) . . ?
As2 K2 K3 155.5(2) 3 . ?
As2 K2 K3 78.1(2) 7_556 . ?
K3 K2 K3 108.5(5) 7_566 . ?
K3 K2 K3 108.5(5) 7_556 . ?
As2 K2 K1 55.15(3) 1_565 3_455 ?
As2 K2 K1 55.15(3) . 3_455 ?
As1 K2 K1 56.85(4) 1_565 3_455 ?
As1 K2 K1 56.85(4) . 3_455 ?
As2 K2 K1 141.64(7) 3 3_455 ?
As2 K2 K1 140.96(7) 7_556 3_455 ?
K3 K2 K1 133.75(19) 7_566 3_455 ?
K3 K2 K1 133.75(19) 7_556 3_455 ?
K3 K2 K1 62.9(2) . 3_455 ?
As2 K2 K3 86.4(2) 1_565 3 ?
As2 K2 K3 157.0(4) . 3 ?
As1 K2 K3 85.84(16) 1_565 3 ?
As1 K2 K3 155.3(4) . 3 ?
As2 K2 K3 54.1(4) 3 3 ?
As2 K2 K3 53.5(3) 7_556 3 ?
K3 K2 K3 5.5(3) 7_566 3 ?
K3 K2 K3 87.05(5) 7_556 3 ?
K3 K2 K3 109.6(5) . 3 ?
K1 K2 K3 139.20(16) 3_455 3 ?
As2 K2 K3 157.0(4) 1_565 3_545 ?
As2 K2 K3 86.4(2) . 3_545 ?
As1 K2 K3 155.3(4) 1_565 3_545 ?
As1 K2 K3 85.84(16) . 3_545 ?
As2 K2 K3 54.1(4) 3 3_545 ?
As2 K2 K3 53.5(3) 7_556 3_545 ?
K3 K2 K3 87.05(5) 7_566 3_545 ?
K3 K2 K3 5.5(3) 7_556 3_545 ?
K3 K2 K3 109.6(5) . 3_545 ?
K1 K2 K3 139.20(16) 3_455 3_545 ?
K3 K2 K3 81.6(3) 3 3_545 ?
K3 K3 As2 82(4) 5_566 1_565 ?
K3 K3 As2 82(4) 5_566 . ?
As2 K3 As2 98.4(7) 1_565 . ?
K3 K3 As2 89(4) 5_566 5_566 ?
As2 K3 As2 80.29(4) 1_565 5_566 ?
As2 K3 As2 171.2(5) . 5_566 ?
K3 K3 As2 89(4) 5_566 5_556 ?
As2 K3 As2 171.2(5) 1_565 5_556 ?
As2 K3 As2 80.29(4) . 5_556 ?
As2 K3 As2 99.6(8) 5_566 5_556 ?
K3 K3 K2 133.5(6) 5_566 7_566 ?
As2 K3 K2 60.2(2) 1_565 7_566 ?
As2 K3 K2 126.6(8) . 7_566 ?
As2 K3 K2 60.31(15) 5_566 7_566 ?
As2 K3 K2 127.5(6) 5_556 7_566 ?
K3 K3 K2 133.5(6) 5_566 7_556 ?
As2 K3 K2 126.6(8) 1_565 7_556 ?
As2 K3 K2 60.2(2) . 7_556 ?
As2 K3 K2 127.5(6) 5_566 7_556 ?
As2 K3 K2 60.31(15) 5_556 7_556 ?
K2 K3 K2 92.5(4) 7_566 7_556 ?
K3 K3 K2 112(7) 5_566 . ?
As2 K3 K2 57.0(4) 1_565 . ?
As2 K3 K2 57.0(4) . . ?
As2 K3 K2 127.3(4) 5_566 . ?
As2 K3 K2 127.3(4) 5_556 . ?
K2 K3 K2 71.5(5) 7_566 . ?
K2 K3 K2 71.5(5) 7_556 . ?
K3 K3 K1 121(7) 5_566 7_556 ?
As2 K3 K1 128.0(2) 1_565 7_556 ?
As2 K3 K1 128.0(2) . 7_556 ?
As2 K3 K1 57.2(4) 5_566 7_556 ?
As2 K3 K1 57.2(4) 5_556 7_556 ?
K2 K3 K1 72.5(3) 7_566 7_556 ?
K2 K3 K1 72.5(3) 7_556 7_556 ?
K2 K3 K1 127.0(4) . 7_556 ?
K3 K3 K1 52(6) 5_566 3_455 ?
As2 K3 K1 54.0(3) 1_565 3_455 ?
As2 K3 K1 54.0(3) . 3_455 ?
As2 K3 K1 119.9(3) 5_566 3_455 ?
As2 K3 K1 119.9(3) 5_556 3_455 ?
K2 K3 K1 111.6(6) 7_566 3_455 ?
K2 K3 K1 111.6(6) 7_556 3_455 ?
K2 K3 K1 59.5(4) . 3_455 ?
K1 K3 K1 173.5(7) 7_556 3_455 ?
K3 K3 K2 41.0(7) 5_566 3_445 ?
As2 K3 K2 115.6(4) 1_565 3_445 ?
As2 K3 K2 56.15(13) . 3_445 ?
As2 K3 K2 116.4(7) 5_566 3_445 ?
As2 K3 K2 56.4(2) 5_556 3_445 ?
K2 K3 K2 174.5(3) 7_566 3_445 ?
K2 K3 K2 92.95(5) 7_556 3_445 ?
K2 K3 K2 109.6(5) . 3_445 ?
K1 K3 K2 109.9(6) 7_556 3_445 ?
K1 K3 K2 65.5(2) 3_455 3_445 ?
K3 K3 K2 41.0(7) 5_566 3_455 ?
As2 K3 K2 56.15(13) 1_565 3_455 ?
As2 K3 K2 115.6(4) . 3_455 ?
As2 K3 K2 56.4(2) 5_566 3_455 ?
As2 K3 K2 116.4(7) 5_556 3_455 ?
K2 K3 K2 92.95(5) 7_566 3_455 ?
K2 K3 K2 174.5(3) 7_556 3_455 ?
K2 K3 K2 109.6(5) . 3_455 ?
K1 K3 K2 109.9(6) 7_556 3_455 ?
K1 K3 K2 65.5(2) 3_455 3_455 ?
K2 K3 K2 81.6(3) 3_445 3_455 ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
As1 As2 2.4244(14) . ?
As1 As1 2.4461(18) 5 ?
As1 K1 3.4204(15) 7_545 ?
As1 K1 3.4204(15) 7 ?
As1 K1 3.448(2) . ?
As1 K2 3.4713(16) . ?
As1 K2 3.4713(16) 1_545 ?
As1 K1 3.5089(16) 3_445 ?
As1 K1 3.5089(16) 3_455 ?
As2 K3 3.441(19) . ?
As2 K3 3.441(19) 1_545 ?
As2 K1 3.4108(15) 3_445 ?
As2 K1 3.4108(15) 3_455 ?
As2 K2 3.4636(16) . ?
As2 K2 3.4636(16) 1_545 ?
As2 K3 3.41(2) 5_566 ?
As2 K3 3.41(2) 5_556 ?
As2 K2 3.530(2) 3_445 ?
As2 K2 3.535(3) 7_556 ?
K1 As2 3.4108(15) 3 ?
K1 As2 3.4108(15) 3_545 ?
K1 As1 3.4204(15) 7_545 ?
K1 As1 3.4204(15) 7 ?
K1 As1 3.5089(16) 3 ?
K1 As1 3.5089(16) 3_545 ?
K1 K3 3.69(2) 7_556 ?
K1 K3 3.99(2) 3_545 ?
K1 K1 3.857(4) 5_655 ?
K1 K2 3.864(3) 3_545 ?
K1 K1 4.042(3) 7_545 ?
K2 As2 3.4636(16) 1_565 ?
K2 As1 3.4712(16) 1_565 ?
K2 As2 3.530(2) 3 ?
K2 As2 3.535(3) 7_556 ?
K2 K3 3.607(11) 7_566 ?
K2 K3 3.607(11) 7_556 ?
K2 K3 3.79(3) . ?
K2 K1 3.864(3) 3_455 ?
K2 K3 3.988(12) 3 ?
K2 K3 3.988(12) 3_545 ?
K3 K3 0.53(3) 5_566 ?
K3 As2 3.441(19) 1_565 ?
K3 As2 3.41(2) 5_566 ?
K3 As2 3.41(2) 5_556 ?
K3 K2 3.607(11) 7_566 ?
K3 K2 3.607(11) 7_556 ?
K3 K1 3.69(2) 7_556 ?
K3 K1 3.99(2) 3_455 ?
K3 K2 3.988(12) 3_445 ?
K3 K2 3.988(12) 3_455 ?
