#------------------------------------------------------------------------------
#$Date: 2016-03-23 21:45:56 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179456 $
#$URL: svn://www.crystallography.net/cod/cif/4/33/53/4335332.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_4335332
loop_
_publ_author_name
'Xiong Chen'
'Jin-Ni Shen'
'Li-Ming Wu'
'Ling Chen'
_publ_section_title
;
 A Ferrimagnetic Zintl Phase Pr4MnSb9: Synthesis, Structure, and Physical
 Properties
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              7441
_journal_page_last               7447
_journal_paper_doi               10.1021/ic400209x
_journal_volume                  52
_journal_year                    2013
_chemical_formula_moiety         'Mn Pr4 Sb9'
_chemical_formula_sum            'Mn Pr4 Sb9'
_chemical_formula_weight         1714.33
_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_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 98.050(14)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   24.12(2)
_cell_length_b                   4.203(3)
_cell_length_c                   15.668(13)
_cell_measurement_reflns_used    1037
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      27.4217
_cell_measurement_theta_min      2.6258
_cell_volume                     1573(2)
_computing_cell_refinement       'CrystalClear (Rigaku Inc., 2007)'
_computing_data_collection       'CrystalClear (Rigaku Inc., 2007)'
_computing_data_reduction        'CrystalClear (Rigaku Inc., 2007)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_detector_area_resol_mean 13.6612
_diffrn_measured_fraction_theta_full 0.996
_diffrn_measured_fraction_theta_max 0.996
_diffrn_measurement_device_type  Mercury2
_diffrn_measurement_method       CCD_Profile_fitting
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0384
_diffrn_reflns_av_sigmaI/netI    0.0317
_diffrn_reflns_limit_h_max       28
_diffrn_reflns_limit_h_min       -28
_diffrn_reflns_limit_k_max       4
_diffrn_reflns_limit_k_min       -4
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_number            4970
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         25.00
_diffrn_reflns_theta_min         2.00
_exptl_absorpt_coefficient_mu    28.031
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.3359
_exptl_absorpt_correction_type   multi-scan
_exptl_crystal_colour            Grey
_exptl_crystal_density_diffrn    7.241
_exptl_crystal_description       Prism
_exptl_crystal_F_000             2880
_exptl_crystal_size_max          0.1200
_exptl_crystal_size_mid          0.1000
_exptl_crystal_size_min          0.0800
_refine_diff_density_max         2.950
_refine_diff_density_min         -1.695
_refine_diff_density_rms         0.440
_refine_ls_extinction_coef       0.00025(3)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   1.098
_refine_ls_matrix_type           full
_refine_ls_number_parameters     88
_refine_ls_number_reflns         1567
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.098
_refine_ls_R_factor_all          0.0387
_refine_ls_R_factor_gt           0.0355
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0519P)²+88.0277P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0931
_refine_ls_wR_factor_ref         0.0975
_reflns_number_gt                1492
_reflns_number_total             1567
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic400209x_si_002.cif
_cod_data_source_block           a
_cod_database_code               4335332
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
Pr1 Pr 0.06649(4) 0.0000 0.39360(5) 0.0052(2) Uani 1 2 d S
Pr2 Pr 0.05958(4) 0.0000 0.81954(5) 0.0068(3) Uani 1 2 d S
Pr3 Pr 0.11193(4) 0.0000 0.14348(5) 0.0061(2) Uani 1 2 d S
Pr4 Pr 0.20616(4) 0.0000 0.61250(6) 0.0063(2) Uani 1 2 d S
Mn Mn 0.27061(13) 0.0000 0.12532(18) 0.0171(7) Uani 1 2 d S
Sb1 Sb 0.53948(5) 0.0000 0.23787(7) 0.0062(3) Uani 1 2 d S
Sb2 Sb 0.36004(5) 0.0000 0.27397(7) 0.0085(3) Uani 1 2 d S
Sb3 Sb 0.07176(5) 0.0000 0.61377(7) 0.0088(3) Uani 1 2 d S
Sb4 Sb 0.0000 0.5000 0.5000 0.0061(3) Uani 1 4 d S
Sb5 Sb 0.33356(5) 0.0000 0.53977(7) 0.0071(3) Uani 1 2 d S
Sb6 Sb 0.19153(4) 0.0000 0.33405(7) 0.0077(3) Uani 1 2 d S
Sb7 Sb 0.71490(5) 0.0000 0.19786(7) 0.0088(3) Uani 1 2 d S
Sb8 Sb 0.40891(5) 0.0000 0.01902(7) 0.0088(3) Uani 1 2 d S
Sb9 Sb 0.0000 0.0000 0.0000 0.0082(4) Uani 1 4 d S
Sb10 Sb 0.81276(6) 0.0000 0.02838(9) 0.0210(3) Uani 1 2 d S
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Mn Mn 0.3368 0.7283 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Sb Sb -0.5866 1.5461 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Pr Pr -0.2180 2.8214 '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
Sb1 Pr1 Sb1 81.57(7) 3_445 3_455
Sb1 Pr1 Sb4 84.51(6) 3_445 1_545
Sb1 Pr1 Sb4 138.68(5) 3_455 1_545
Sb1 Pr1 Sb4 138.68(5) 3_445 .
Sb1 Pr1 Sb4 84.51(6) 3_455 .
Sb4 Pr1 Sb4 80.79(6) 1_545 .
Sb1 Pr1 Sb5 136.60(4) 3_445 7_556
Sb1 Pr1 Sb5 83.33(5) 3_455 7_556
Sb4 Pr1 Sb5 130.57(5) 1_545 7_556
Sb4 Pr1 Sb5 79.30(6) . 7_556
Sb1 Pr1 Sb5 83.33(5) 3_445 7_546
Sb1 Pr1 Sb5 136.60(4) 3_455 7_546
Sb4 Pr1 Sb5 79.30(6) 1_545 7_546
Sb4 Pr1 Sb5 130.57(5) . 7_546
Sb5 Pr1 Sb5 80.34(7) 7_556 7_546
Sb1 Pr1 Sb6 83.15(4) 3_445 .
Sb1 Pr1 Sb6 83.15(4) 3_455 .
Sb4 Pr1 Sb6 133.39(3) 1_545 .
Sb4 Pr1 Sb6 133.39(3) . .
Sb5 Pr1 Sb6 54.72(5) 7_556 .
Sb5 Pr1 Sb6 54.72(5) 7_546 .
Sb1 Pr1 Sb3 82.99(3) 3_445 5_556
Sb1 Pr1 Sb3 82.99(3) 3_455 5_556
Sb4 Pr1 Sb3 56.72(3) 1_545 5_556
Sb4 Pr1 Sb3 56.72(3) . 5_556
Sb5 Pr1 Sb3 134.88(4) 7_556 5_556
Sb5 Pr1 Sb3 134.88(4) 7_546 5_556
Sb6 Pr1 Sb3 161.66(4) . 5_556
Sb1 Pr1 Sb3 137.47(4) 3_445 .
Sb1 Pr1 Sb3 137.47(4) 3_455 .
Sb4 Pr1 Sb3 55.60(3) 1_545 .
Sb4 Pr1 Sb3 55.60(3) . .
Sb5 Pr1 Sb3 75.90(3) 7_556 .
Sb5 Pr1 Sb3 75.90(3) 7_546 .
Sb6 Pr1 Sb3 112.31(4) . .
Sb3 Pr1 Sb3 86.02(4) 5_556 .
Sb1 Pr2 Sb1 81.65(7) 7_546 7_556
Sb1 Pr2 Sb3 83.70(4) 7_546 .
Sb1 Pr2 Sb3 83.70(4) 7_556 .
Sb1 Pr2 Sb8 135.59(4) 7_546 7_556
Sb1 Pr2 Sb8 83.13(5) 7_556 7_556
Sb3 Pr2 Sb8 135.42(4) . 7_556
Sb1 Pr2 Sb8 83.13(5) 7_546 7_546
Sb1 Pr2 Sb8 135.59(4) 7_556 7_546
Sb3 Pr2 Sb8 135.42(4) . 7_546
Sb8 Pr2 Sb8 79.27(7) 7_556 7_546
Sb1 Pr2 Sb2 138.10(5) 7_546 7_556
Sb1 Pr2 Sb2 85.42(6) 7_556 7_556
Sb3 Pr2 Sb2 55.26(3) . 7_556
Sb8 Pr2 Sb2 81.35(6) 7_556 7_556
Sb8 Pr2 Sb2 130.81(5) 7_546 7_556
Sb1 Pr2 Sb2 85.42(6) 7_546 7_546
Sb1 Pr2 Sb2 138.10(5) 7_556 7_546
Sb3 Pr2 Sb2 55.26(3) . 7_546
Sb8 Pr2 Sb2 130.81(5) 7_556 7_546
Sb8 Pr2 Sb2 81.35(6) 7_546 7_546
Sb2 Pr2 Sb2 78.14(6) 7_556 7_546
Sb1 Pr2 Sb9 81.15(5) 7_546 1_556
Sb1 Pr2 Sb9 81.15(5) 7_556 1_556
Sb3 Pr2 Sb9 159.93(4) . 1_556
Sb8 Pr2 Sb9 55.35(5) 7_556 1_556
Sb8 Pr2 Sb9 55.35(5) 7_546 1_556
Sb2 Pr2 Sb9 135.74(3) 7_556 1_556
Sb2 Pr2 Sb9 135.74(3) 7_546 1_556
Sb1 Pr2 Sb10 135.61(4) 7_546 5_656
Sb1 Pr2 Sb10 135.61(4) 7_556 5_656
Sb3 Pr2 Sb10 117.53(6) . 5_656
Sb8 Pr2 Sb10 53.92(4) 7_556 5_656
Sb8 Pr2 Sb10 53.92(4) 7_546 5_656
Sb2 Pr2 Sb10 78.23(6) 7_556 5_656
Sb2 Pr2 Sb10 78.23(6) 7_546 5_656
Sb9 Pr2 Sb10 82.54(7) 1_556 5_656
Sb1 Pr3 Sb1 81.42(7) 3_445 3_455
Sb1 Pr3 Sb9 82.34(6) 3_445 .
Sb1 Pr3 Sb9 82.34(6) 3_455 .
Sb1 Pr3 Sb7 137.70(5) 3_445 3_455
Sb1 Pr3 Sb7 84.39(6) 3_455 3_455
Sb9 Pr3 Sb7 134.73(4) . 3_455
Sb1 Pr3 Sb7 84.39(6) 3_445 3_445
Sb1 Pr3 Sb7 137.70(5) 3_455 3_445
Sb9 Pr3 Sb7 134.73(4) . 3_445
Sb7 Pr3 Sb7 79.87(7) 3_455 3_445
Sb1 Pr3 Sb8 84.52(6) 3_445 7_545
Sb1 Pr3 Sb8 137.65(5) 3_455 7_545
Sb9 Pr3 Sb8 56.21(4) . 7_545
Sb7 Pr3 Sb8 129.83(5) 3_455 7_545
Sb7 Pr3 Sb8 79.59(5) 3_445 7_545
Sb1 Pr3 Sb8 137.65(5) 3_445 7
Sb1 Pr3 Sb8 84.52(6) 3_455 7
Sb9 Pr3 Sb8 56.21(4) . 7
Sb7 Pr3 Sb8 79.59(5) 3_455 7
Sb7 Pr3 Sb8 129.83(5) 3_445 7
Sb8 Pr3 Sb8 79.53(7) 7_545 7
Sb1 Pr3 Sb6 82.50(6) 3_445 .
Sb1 Pr3 Sb6 82.50(6) 3_455 .
Sb9 Pr3 Sb6 159.95(4) . .
Sb7 Pr3 Sb6 56.16(3) 3_455 .
Sb7 Pr3 Sb6 56.16(3) 3_445 .
Sb8 Pr3 Sb6 134.77(4) 7_545 .
Sb8 Pr3 Sb6 134.77(4) 7 .
Sb1 Pr3 Sb10 137.43(3) 3_445 5_655
Sb1 Pr3 Sb10 137.43(3) 3_455 5_655
Sb9 Pr3 Sb10 86.42(7) . 5_655
Sb7 Pr3 Sb10 74.94(5) 3_455 5_655
Sb7 Pr3 Sb10 74.94(5) 3_445 5_655
Sb8 Pr3 Sb10 55.64(5) 7_545 5_655
Sb8 Pr3 Sb10 55.64(5) 7 5_655
Sb6 Pr3 Sb10 113.63(8) . 5_655
Sb5 Pr4 Sb5 81.40(7) 7_546 7_556
Sb5 Pr4 Sb3 79.10(4) 7_546 .
Sb5 Pr4 Sb3 79.10(4) 7_556 .
Sb5 Pr4 Sb6 138.28(4) 7_546 7_556
Sb5 Pr4 Sb6 84.59(5) 7_556 7_556
Sb3 Pr4 Sb6 136.01(4) . 7_556
Sb5 Pr4 Sb6 84.59(5) 7_546 7_546
Sb5 Pr4 Sb6 138.27(4) 7_556 7_546
Sb3 Pr4 Sb6 136.01(4) . 7_546
Sb6 Pr4 Sb6 80.27(7) 7_556 7_546
Sb5 Pr4 Sb7 137.86(4) 7_546 5_656
Sb5 Pr4 Sb7 137.86(4) 7_556 5_656
Sb3 Pr4 Sb7 116.48(5) . 5_656
Sb6 Pr4 Sb7 56.47(3) 7_556 5_656
Sb6 Pr4 Sb7 56.47(3) 7_546 5_656
Sb5 Pr4 Sb2 134.19(6) 7_546 7_556
Sb5 Pr4 Sb2 82.41(6) 7_556 7_556
Sb3 Pr4 Sb2 55.83(4) . 7_556
Sb6 Pr4 Sb2 81.79(6) 7_556 7_556
Sb6 Pr4 Sb2 132.60(5) 7_546 7_556
Sb7 Pr4 Sb2 77.09(6) 5_656 7_556
Sb5 Pr4 Sb2 82.41(6) 7_546 7_546
Sb5 Pr4 Sb2 134.19(6) 7_556 7_546
Sb3 Pr4 Sb2 55.83(4) . 7_546
Sb6 Pr4 Sb2 132.60(5) 7_556 7_546
Sb6 Pr4 Sb2 81.79(6) 7_546 7_546
Sb7 Pr4 Sb2 77.09(6) 5_656 7_546
Sb2 Pr4 Sb2 78.96(6) 7_556 7_546
Sb5 Pr4 Sb5 86.63(5) 7_546 .
Sb5 Pr4 Sb5 86.63(5) 7_556 .
Sb3 Pr4 Sb5 161.11(4) . .
Sb6 Pr4 Sb5 53.35(5) 7_556 .
Sb6 Pr4 Sb5 53.35(5) 7_546 .
Sb7 Pr4 Sb5 82.41(7) 5_656 .
Sb2 Pr4 Sb5 134.65(3) 7_556 .
Sb2 Pr4 Sb5 134.65(3) 7_546 .
Sb7 Mn Sb7 96.44(11) 3_445 3_455
Sb7 Mn Sb10 83.76(6) 3_445 3_445
Sb7 Mn Sb10 170.61(13) 3_455 3_445
Sb7 Mn Sb10 170.61(13) 3_445 3_455
Sb7 Mn Sb10 83.76(6) 3_455 3_455
Sb10 Mn Sb10 94.50(10) 3_445 3_455
Sb7 Mn Sb10 91.17(9) 3_445 5_655
Sb7 Mn Sb10 91.17(9) 3_455 5_655
Sb10 Mn Sb10 79.44(9) 3_445 5_655
Sb10 Mn Sb10 79.44(9) 3_455 5_655
Sb7 Mn Sb2 91.08(9) 3_445 .
Sb7 Mn Sb2 91.08(9) 3_455 .
Sb10 Mn Sb2 98.31(10) 3_445 .
Sb10 Mn Sb2 98.31(9) 3_455 .
Sb10 Mn Sb2 176.62(11) 5_655 .
Pr2 Sb1 Pr2 81.65(7) 7_546 7_556
Pr2 Sb1 Pr1 134.66(5) 7_546 3
Pr2 Sb1 Pr1 81.30(5) 7_556 3
Pr2 Sb1 Pr1 81.30(5) 7_546 3_545
Pr2 Sb1 Pr1 134.66(5) 7_556 3_545
Pr1 Sb1 Pr1 81.57(7) 3 3_545
Pr2 Sb1 Pr3 136.69(6) 7_546 3
Pr2 Sb1 Pr3 82.81(6) 7_556 3
Pr1 Sb1 Pr3 81.77(6) 3 3
Pr1 Sb1 Pr3 135.15(5) 3_545 3
Pr2 Sb1 Pr3 82.81(6) 7_546 3_545
Pr2 Sb1 Pr3 136.69(6) 7_556 3_545
Pr1 Sb1 Pr3 135.15(5) 3 3_545
Pr1 Sb1 Pr3 81.77(6) 3_545 3_545
Pr3 Sb1 Pr3 81.42(7) 3 3_545
Mn Sb2 Sb3 136.75(4) . 7_556
Mn Sb2 Sb3 136.75(4) . 7_546
Sb3 Sb2 Sb3 86.51(7) 7_556 7_546
Mn Sb2 Pr4 94.02(7) . 7_556
Sb3 Sb2 Pr4 61.08(6) 7_556 7_556
Sb3 Sb2 Pr4 112.81(7) 7_546 7_556
Mn Sb2 Pr4 94.02(7) . 7_546
Sb3 Sb2 Pr4 112.81(7) 7_556 7_546
Sb3 Sb2 Pr4 61.08(6) 7_546 7_546
Pr4 Sb2 Pr4 78.96(6) 7_556 7_546
Mn Sb2 Pr2 93.39(7) . 7_556
Sb3 Sb2 Pr2 61.44(6) 7_556 7_556
Sb3 Sb2 Pr2 112.69(7) 7_546 7_556
Pr4 Sb2 Pr2 100.96(6) 7_556 7_556
Pr4 Sb2 Pr2 172.58(4) 7_546 7_556
Mn Sb2 Pr2 93.39(7) . 7_546
Sb3 Sb2 Pr2 112.69(7) 7_556 7_546
Sb3 Sb2 Pr2 61.44(6) 7_546 7_546
Pr4 Sb2 Pr2 172.58(4) 7_556 7_546
Pr4 Sb2 Pr2 100.96(6) 7_546 7_546
Pr2 Sb2 Pr2 78.14(6) 7_556 7_546
Sb2 Sb3 Sb2 86.51(7) 7_556 7_546
Sb2 Sb3 Sb4 178.73(4) 7_556 1_545
Sb2 Sb3 Sb4 94.37(6) 7_546 1_545
Sb2 Sb3 Sb4 94.37(6) 7_556 .
Sb2 Sb3 Sb4 178.73(4) 7_546 .
Sb4 Sb3 Sb4 84.73(6) 1_545 .
Sb2 Sb3 Pr4 63.09(4) 7_556 .
Sb2 Sb3 Pr4 63.09(4) 7_546 .
Sb4 Sb3 Pr4 118.14(4) 1_545 .
Sb4 Sb3 Pr4 118.14(4) . .
Sb2 Sb3 Pr2 63.30(4) 7_556 .
Sb2 Sb3 Pr2 63.30(4) 7_546 .
Sb4 Sb3 Pr2 116.30(4) 1_545 .
Sb4 Sb3 Pr2 116.30(4) . .
Pr4 Sb3 Pr2 103.49(4) . .
Sb2 Sb3 Pr1 118.38(4) 7_556 5_556
Sb2 Sb3 Pr1 118.38(4) 7_546 5_556
Sb4 Sb3 Pr1 60.38(4) 1_545 5_556
Sb4 Sb3 Pr1 60.38(4) . 5_556
Pr4 Sb3 Pr1 177.68(4) . 5_556
Pr2 Sb3 Pr1 78.83(4) . 5_556
Sb2 Sb3 Pr1 121.17(4) 7_556 .
Sb2 Sb3 Pr1 121.17(4) 7_546 .
Sb4 Sb3 Pr1 59.09(3) 1_545 .
Sb4 Sb3 Pr1 59.09(3) . .
Pr4 Sb3 Pr1 83.70(3) . .
Pr2 Sb3 Pr1 172.81(4) . .
Pr1 Sb3 Pr1 93.98(4) 5_556 .
Sb3 Sb4 Sb3 180.0 5_556 1_565
Sb3 Sb4 Sb3 84.73(6) 5_556 5_566
Sb3 Sb4 Sb3 95.27(6) 1_565 5_566
Sb3 Sb4 Sb3 95.27(6) 5_556 .
Sb3 Sb4 Sb3 84.73(6) 1_565 .
Sb3 Sb4 Sb3 180.0 5_566 .
Sb3 Sb4 Pr1 117.11(6) 5_556 5_566
Sb3 Sb4 Pr1 62.89(6) 1_565 5_566
Sb3 Sb4 Pr1 65.31(6) 5_566 5_566
Sb3 Sb4 Pr1 114.69(6) . 5_566
Sb3 Sb4 Pr1 65.31(6) 5_556 5_556
Sb3 Sb4 Pr1 114.69(6) 1_565 5_556
Sb3 Sb4 Pr1 117.11(6) 5_566 5_556
Sb3 Sb4 Pr1 62.89(6) . 5_556
Pr1 Sb4 Pr1 80.79(6) 5_566 5_556
Sb3 Sb4 Pr1 62.89(6) 5_556 .
Sb3 Sb4 Pr1 117.11(6) 1_565 .
Sb3 Sb4 Pr1 114.69(6) 5_566 .
Sb3 Sb4 Pr1 65.31(6) . .
Pr1 Sb4 Pr1 180.0 5_566 .
Pr1 Sb4 Pr1 99.21(6) 5_556 .
Sb3 Sb4 Pr1 114.69(6) 5_556 1_565
Sb3 Sb4 Pr1 65.31(6) 1_565 1_565
Sb3 Sb4 Pr1 62.89(6) 5_566 1_565
Sb3 Sb4 Pr1 117.11(6) . 1_565
Pr1 Sb4 Pr1 99.21(6) 5_566 1_565
Pr1 Sb4 Pr1 180.0 5_556 1_565
Pr1 Sb4 Pr1 80.79(6) . 1_565
Sb6 Sb5 Sb6 88.77(8) 7_556 7_546
Sb6 Sb5 Pr4 151.27(5) 7_556 7_546
Sb6 Sb5 Pr4 87.97(7) 7_546 7_546
Sb6 Sb5 Pr4 87.97(7) 7_556 7_556
Sb6 Sb5 Pr4 151.27(5) 7_546 7_556
Pr4 Sb5 Pr4 81.40(7) 7_546 7_556
Sb6 Sb5 Pr1 63.01(5) 7_556 7_556
Sb6 Sb5 Pr1 116.65(6) 7_546 7_556
Pr4 Sb5 Pr1 141.98(5) 7_546 7_556
Pr4 Sb5 Pr1 86.93(5) 7_556 7_556
Sb6 Sb5 Pr1 116.65(6) 7_556 7_546
Sb6 Sb5 Pr1 63.01(5) 7_546 7_546
Pr4 Sb5 Pr1 86.93(5) 7_546 7_546
Pr4 Sb5 Pr1 141.98(5) 7_556 7_546
Pr1 Sb5 Pr1 80.34(7) 7_556 7_546
Sb6 Sb5 Pr4 60.53(3) 7_556 .
Sb6 Sb5 Pr4 60.53(3) 7_546 .
Pr4 Sb5 Pr4 93.37(5) 7_546 .
Pr4 Sb5 Pr4 93.37(5) 7_556 .
Pr1 Sb5 Pr4 123.49(5) 7_556 .
Pr1 Sb5 Pr4 123.49(5) 7_546 .
Sb5 Sb6 Sb5 88.77(8) 7_556 7_546
Sb5 Sb6 Sb7 177.71(4) 7_556 3_445
Sb5 Sb6 Sb7 92.95(7) 7_546 3_445
Sb5 Sb6 Sb7 92.95(7) 7_556 3_455
Sb5 Sb6 Sb7 177.71(4) 7_546 3_455
Sb7 Sb6 Sb7 85.28(7) 3_445 3_455
Sb5 Sb6 Pr4 66.11(5) 7_556 7_556
Sb5 Sb6 Pr4 119.79(6) 7_546 7_556
Sb7 Sb6 Pr4 114.17(6) 3_445 7_556
Sb7 Sb6 Pr4 62.36(5) 3_455 7_556
Sb5 Sb6 Pr4 119.79(6) 7_556 7_546
Sb5 Sb6 Pr4 66.11(5) 7_546 7_546
Sb7 Sb6 Pr4 62.36(5) 3_445 7_546
Sb7 Sb6 Pr4 114.17(6) 3_455 7_546
Pr4 Sb6 Pr4 80.27(7) 7_556 7_546
Sb5 Sb6 Pr1 62.27(3) 7_556 .
Sb5 Sb6 Pr1 62.27(3) 7_546 .
Sb7 Sb6 Pr1 117.30(4) 3_445 .
Sb7 Sb6 Pr1 117.30(4) 3_455 .
Pr4 Sb6 Pr1 128.32(5) 7_556 .
Pr4 Sb6 Pr1 128.32(5) 7_546 .
Sb5 Sb6 Pr3 116.61(5) 7_556 .
Sb5 Sb6 Pr3 116.61(5) 7_546 .
Sb7 Sb6 Pr3 61.23(5) 3_445 .
Sb7 Sb6 Pr3 61.23(5) 3_455 .
Pr4 Sb6 Pr3 123.59(4) 7_556 .
Pr4 Sb6 Pr3 123.59(4) 7_546 .
Pr1 Sb6 Pr3 79.43(6) . .
Mn Sb7 Mn 96.44(11) 3 3_545
Mn Sb7 Sb6 85.13(7) 3 3
Mn Sb7 Sb6 157.73(8) 3_545 3
Mn Sb7 Sb6 157.73(8) 3 3_545
Mn Sb7 Sb6 85.13(7) 3_545 3_545
Sb6 Sb7 Sb6 85.28(7) 3 3_545
Mn Sb7 Pr3 139.55(8) 3 3_545
Mn Sb7 Pr3 78.67(8) 3_545 3_545
Sb6 Sb7 Pr3 114.18(6) 3 3_545
Sb6 Sb7 Pr3 62.61(5) 3_545 3_545
Mn Sb7 Pr3 78.67(8) 3 3
Mn Sb7 Pr3 139.55(8) 3_545 3
Sb6 Sb7 Pr3 62.61(5) 3 3
Sb6 Sb7 Pr3 114.18(6) 3_545 3
Pr3 Sb7 Pr3 79.87(7) 3_545 3
Mn Sb7 Pr4 96.64(8) 3 5_656
Mn Sb7 Pr4 96.64(8) 3_545 5_656
Sb6 Sb7 Pr4 61.17(5) 3 5_656
Sb6 Sb7 Pr4 61.17(5) 3_545 5_656
Pr3 Sb7 Pr4 123.77(4) 3_545 5_656
Pr3 Sb7 Pr4 123.77(4) 3 5_656
Sb9 Sb8 Sb9 85.88(7) 3 3_545
Sb9 Sb8 Sb10 176.89(4) 3 3_445
Sb9 Sb8 Sb10 95.11(7) 3_545 3_445
Sb9 Sb8 Sb10 95.11(7) 3 3_455
Sb9 Sb8 Sb10 176.89(4) 3_545 3_455
Sb10 Sb8 Sb10 83.75(8) 3_445 3_455
Sb9 Sb8 Pr3 113.24(5) 3 7_545
Sb9 Sb8 Pr3 61.52(4) 3_545 7_545
Sb10 Sb8 Pr3 64.87(4) 3_445 7_545
Sb10 Sb8 Pr3 115.42(5) 3_455 7_545
Sb9 Sb8 Pr3 61.52(4) 3 7
Sb9 Sb8 Pr3 113.24(5) 3_545 7
Sb10 Sb8 Pr3 115.42(5) 3_445 7
Sb10 Sb8 Pr3 64.87(4) 3_455 7
Pr3 Sb8 Pr3 79.53(7) 7_545 7
Sb9 Sb8 Pr2 63.18(4) 3 7_556
Sb9 Sb8 Pr2 114.70(5) 3_545 7_556
Sb10 Sb8 Pr2 118.83(5) 3_445 7_556
Sb10 Sb8 Pr2 68.33(5) 3_455 7_556
Pr3 Sb8 Pr2 175.47(5) 7_545 7_556
Pr3 Sb8 Pr2 100.42(7) 7 7_556
Sb9 Sb8 Pr2 114.70(5) 3 7_546
Sb9 Sb8 Pr2 63.18(4) 3_545 7_546
Sb10 Sb8 Pr2 68.33(5) 3_445 7_546
Sb10 Sb8 Pr2 118.83(5) 3_455 7_546
Pr3 Sb8 Pr2 100.42(7) 7_545 7_546
Pr3 Sb8 Pr2 175.47(5) 7 7_546
Pr2 Sb8 Pr2 79.27(7) 7_556 7_546
Sb8 Sb9 Sb8 180.00(3) 3_445 7
Sb8 Sb9 Sb8 85.88(7) 3_445 3_455
Sb8 Sb9 Sb8 94.12(7) 7 3_455
Sb8 Sb9 Sb8 94.12(7) 3_445 7_545
Sb8 Sb9 Sb8 85.88(7) 7 7_545
Sb8 Sb9 Sb8 180.00(3) 3_455 7_545
Sb8 Sb9 Pr3 62.27(5) 3_445 5
Sb8 Sb9 Pr3 117.73(5) 7 5
Sb8 Sb9 Pr3 62.27(5) 3_455 5
Sb8 Sb9 Pr3 117.73(5) 7_545 5
Sb8 Sb9 Pr3 117.73(5) 3_445 .
Sb8 Sb9 Pr3 62.27(5) 7 .
Sb8 Sb9 Pr3 117.73(5) 3_455 .
Sb8 Sb9 Pr3 62.27(5) 7_545 .
Pr3 Sb9 Pr3 180.00(4) 5 .
Sb8 Sb9 Pr2 118.53(3) 3_445 1_554
Sb8 Sb9 Pr2 61.47(3) 7 1_554
Sb8 Sb9 Pr2 118.53(3) 3_455 1_554
Sb8 Sb9 Pr2 61.47(3) 7_545 1_554
Pr3 Sb9 Pr2 80.19(7) 5 1_554
Pr3 Sb9 Pr2 99.81(7) . 1_554
Sb8 Sb9 Pr2 61.47(3) 3_445 5_556
Sb8 Sb9 Pr2 118.53(3) 7 5_556
Sb8 Sb9 Pr2 61.47(3) 3_455 5_556
Sb8 Sb9 Pr2 118.53(3) 7_545 5_556
Pr3 Sb9 Pr2 99.81(7) 5 5_556
Pr3 Sb9 Pr2 80.19(7) . 5_556
Pr2 Sb9 Pr2 180.00(3) 1_554 5_556
Mn Sb10 Mn 94.50(10) 3 3_545
Mn Sb10 Mn 100.56(9) 3 5_655
Mn Sb10 Mn 100.56(9) 3_545 5_655
Mn Sb10 Sb8 81.57(7) 3 3
Mn Sb10 Sb8 146.48(9) 3_545 3
Mn Sb10 Sb8 112.91(6) 5_655 3
Mn Sb10 Sb8 146.48(9) 3 3_545
Mn Sb10 Sb8 81.57(7) 3_545 3_545
Mn Sb10 Sb8 112.91(6) 5_655 3_545
Sb8 Sb10 Sb8 83.75(8) 3 3_545
Mn Sb10 Pr3 132.75(5) 3 5_655
Mn Sb10 Pr3 132.75(5) 3_545 5_655
Mn Sb10 Pr3 74.51(9) 5_655 5_655
Sb8 Sb10 Pr3 59.49(4) 3 5_655
Sb8 Sb10 Pr3 59.49(4) 3_545 5_655
Mn Sb10 Pr2 89.04(8) 3 5_656
Mn Sb10 Pr2 89.04(8) 3_545 5_656
Mn Sb10 Pr2 165.74(7) 5_655 5_656
Sb8 Sb10 Pr2 57.75(5) 3 5_656
Sb8 Sb10 Pr2 57.75(5) 3_545 5_656
Pr3 Sb10 Pr2 91.23(8) 5_655 5_656
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Pr1 Sb1 3.217(2) 3_445
Pr1 Sb1 3.217(2) 3_455
Pr1 Sb4 3.2428(17) 1_545
Pr1 Sb4 3.2428(17) .
Pr1 Sb5 3.258(2) 7_556
Pr1 Sb5 3.258(2) 7_546
Pr1 Sb6 3.279(3) .
Pr1 Sb3 3.320(3) 5_556
Pr1 Sb3 3.434(3) .
Pr2 Sb1 3.214(2) 7_546
Pr2 Sb1 3.214(2) 7_556
Pr2 Sb3 3.278(3) .
Pr2 Sb8 3.294(2) 7_556
Pr2 Sb8 3.294(2) 7_546
Pr2 Sb2 3.334(2) 7_556
Pr2 Sb2 3.334(2) 7_546
Pr2 Sb9 3.346(2) 1_556
Pr2 Sb10 3.620(3) 5_656
Pr3 Sb1 3.2218(19) 3_445
Pr3 Sb1 3.2218(19) 3_455
Pr3 Sb9 3.262(2) .
Pr3 Sb7 3.274(2) 3_455
Pr3 Sb7 3.274(2) 3_445
Pr3 Sb8 3.285(2) 7_545
Pr3 Sb8 3.285(2) 7
Pr3 Sb6 3.316(3) .
Pr3 Sb10 3.452(3) 5_655
Pr4 Sb5 3.223(2) 7_546
Pr4 Sb5 3.223(2) 7_556
Pr4 Sb3 3.244(3) .
Pr4 Sb6 3.260(2) 7_556
Pr4 Sb6 3.260(2) 7_546
Pr4 Sb7 3.297(3) 5_656
Pr4 Sb2 3.3052(19) 7_556
Pr4 Sb2 3.3052(19) 7_546
Pr4 Sb5 3.424(3) .
Mn Sb7 2.818(2) 3_445
Mn Sb7 2.818(2) 3_455
Mn Sb10 2.862(3) 3_445
Mn Sb10 2.862(3) 3_455
Mn Sb10 2.913(4) 5_655
Mn Sb2 2.944(4) .
Sb1 Pr2 3.214(2) 7_546
Sb1 Pr2 3.214(2) 7_556
Sb1 Pr1 3.217(2) 3
Sb1 Pr1 3.217(2) 3_545
Sb1 Pr3 3.2218(19) 3
Sb1 Pr3 3.2218(19) 3_545
Sb2 Sb3 3.0667(19) 7_556
Sb2 Sb3 3.0667(19) 7_546
Sb2 Pr4 3.3052(19) 7_556
Sb2 Pr4 3.3052(19) 7_546
Sb2 Pr2 3.334(2) 7_556
Sb2 Pr2 3.334(2) 7_546
Sb3 Sb2 3.0667(19) 7_556
Sb3 Sb2 3.0667(19) 7_546
Sb3 Sb4 3.1185(18) 1_545
Sb3 Sb4 3.1185(18) .
Sb3 Pr1 3.320(3) 5_556
Sb4 Sb3 3.1185(18) 5_556
Sb4 Sb3 3.1185(18) 1_565
Sb4 Sb3 3.1185(18) 5_566
Sb4 Pr1 3.2428(17) 5_566
Sb4 Pr1 3.2428(17) 5_556
Sb4 Pr1 3.2428(17) 1_565
Sb5 Sb6 3.004(2) 7_556
Sb5 Sb6 3.004(2) 7_546
Sb5 Pr4 3.223(2) 7_546
Sb5 Pr4 3.223(2) 7_556
Sb5 Pr1 3.258(2) 7_556
Sb5 Pr1 3.258(2) 7_546
Sb6 Sb5 3.004(2) 7_556
Sb6 Sb5 3.004(2) 7_546
Sb6 Sb7 3.102(2) 3_445
Sb6 Sb7 3.102(2) 3_455
Sb6 Pr4 3.260(2) 7_556
Sb6 Pr4 3.260(2) 7_546
Sb7 Mn 2.818(2) 3
Sb7 Mn 2.818(2) 3_545
Sb7 Sb6 3.102(2) 3
Sb7 Sb6 3.102(2) 3_545
Sb7 Pr3 3.274(2) 3_545
Sb7 Pr3 3.274(2) 3
Sb7 Pr4 3.297(3) 5_656
Sb8 Sb9 3.085(2) 3
Sb8 Sb9 3.085(2) 3_545
Sb8 Sb10 3.148(2) 3_445
Sb8 Sb10 3.148(2) 3_455
Sb8 Pr3 3.285(2) 7_545
Sb8 Pr3 3.285(2) 7
Sb8 Pr2 3.294(2) 7_556
Sb8 Pr2 3.294(2) 7_546
Sb9 Sb8 3.085(2) 3_445
Sb9 Sb8 3.085(2) 7
Sb9 Sb8 3.085(2) 3_455
Sb9 Sb8 3.085(2) 7_545
Sb9 Pr3 3.262(2) 5
Sb9 Pr2 3.346(2) 1_554
Sb9 Pr2 3.346(2) 5_556
Sb10 Mn 2.862(3) 3
Sb10 Mn 2.862(3) 3_545
Sb10 Mn 2.913(4) 5_655
Sb10 Sb8 3.148(2) 3
Sb10 Sb8 3.148(2) 3_545
Sb10 Pr3 3.452(3) 5_655
Sb10 Pr2 3.620(3) 5_656
