#------------------------------------------------------------------------------
#$Date: 2016-03-24 00:14:39 +0200 (Thu, 24 Mar 2016) $
#$Revision: 179528 $
#$URL: svn://www.crystallography.net/cod/cif/4/34/25/4342581.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_4342581
loop_
_publ_author_name
'Oliynyk, Anton O.'
'Stoyko, Stanislav S.'
'Mar, Arthur'
_publ_section_title
;
 Many Metals Make the Cut: Quaternary Rare-Earth Germanides RE4M2InGe4 (M
 = Fe, Co, Ni, Ru, Rh, Ir) and RE4RhInGe4 Derived from Excision of Slabs
 in RE2InGe2.
;
_journal_issue                   6
_journal_name_full               'Inorganic chemistry'
_journal_page_first              2780
_journal_page_last               2792
_journal_paper_doi               10.1021/ic502955h
_journal_volume                  54
_journal_year                    2015
_chemical_formula_structural     'Ce4 Fe2 In Ge4'
_chemical_formula_sum            'Ce4 Fe2 Ge4 In'
_chemical_formula_weight         1077.36
_chemical_name_common            'cerium iron indium germanide (4/2/1/4)'
_chemical_name_systematic        'cerium iron indium germanide (4/2/1/4)'
_space_group_crystal_system      monoclinic
_space_group_IT_number           12
_space_group_name_Hall           '-C 2y'
_space_group_name_H-M_alt        'C 1 2/m 1'
_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-2013
_cell_angle_alpha                90
_cell_angle_beta                 106.945(3)
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   16.071(4)
_cell_length_b                   4.3480(10)
_cell_length_c                   7.2757(17)
_cell_measurement_reflns_used    3698
_cell_measurement_temperature    173(2)
_cell_measurement_theta_max      33.01
_cell_measurement_theta_min      4.87
_cell_volume                     486.3(2)
_computing_cell_refinement       'Bruker SAINT 8.27B (Bruker, 2011)'
_computing_data_collection       'Bruker APEX 2 (Bruker, 2008)'
_computing_data_reduction        'Bruker SAINT 8.27B'
_computing_molecular_graphics    'ATOMS 5.1 (Dowty, 1999)'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'Bruker SHELXTL'
_computing_structure_solution    'Bruker SHELXTL'
_diffrn_ambient_temperature      173(2)
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 0.979
_diffrn_measurement_device_type  'Bruker PLATFORM/SMART APEX II CCD'
_diffrn_measurement_method       'ω and φ scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0284
_diffrn_reflns_av_unetI/netI     0.0248
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 0.979
_diffrn_reflns_limit_h_max       24
_diffrn_reflns_limit_h_min       -24
_diffrn_reflns_limit_k_max       6
_diffrn_reflns_limit_k_min       -6
_diffrn_reflns_limit_l_max       11
_diffrn_reflns_limit_l_min       -10
_diffrn_reflns_number            3484
_diffrn_reflns_point_group_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 0.979
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         33.219
_diffrn_reflns_theta_min         2.650
_diffrn_source                   'fine-focus sealed tube'
_exptl_absorpt_coefficient_mu    35.584
_exptl_absorpt_correction_T_max  0.4306
_exptl_absorpt_correction_T_min  0.1444
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_process_details   'Bruker SHELXTL (Sheldrick, 2013)'
_exptl_crystal_colour            grey
_exptl_crystal_density_diffrn    7.357
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       irregular
_exptl_crystal_F_000             922
_exptl_crystal_size_max          0.095
_exptl_crystal_size_mid          0.046
_exptl_crystal_size_min          0.032
_refine_diff_density_max         1.594
_refine_diff_density_min         -1.383
_refine_diff_density_rms         0.314
_refine_ls_extinction_coef       0.00026(6)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   1.105
_refine_ls_hydrogen_treatment    undef
_refine_ls_matrix_type           full
_refine_ls_number_parameters     37
_refine_ls_number_reflns         1016
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.105
_refine_ls_R_factor_all          0.0220
_refine_ls_R_factor_gt           0.0174
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0121P)²+1.4656P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0375
_refine_ls_wR_factor_ref         0.0386
_reflns_Friedel_coverage         0.000
_reflns_number_gt                908
_reflns_number_total             1016
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            ic502955h_si_002.cif
_cod_data_source_block           Ce4Fe2InGe4
_cod_depositor_comments
'Adding full bibliography for 4342570--4342590.cif.'
_cod_original_cell_volume        486.34(19)
_cod_database_code               4342581
#BEGIN Tags that were not found in dictionaries:
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_shelx_estimated_absorpt_t_min   0.133
_shelx_estimated_absorpt_t_max   0.396
_shelxl_version_number           2013-4
#END Tags that were not found in dictionaries
loop_
_space_group_symop_operation_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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
Ce1 Ce 0.34776(2) 0.0000 0.06007(4) 0.00763(7) Uani 1 2 d S T P
Ce2 Ce 0.58847(2) 0.0000 0.37604(4) 0.00721(7) Uani 1 2 d S T P
Fe Fe 0.21673(4) 0.0000 0.62609(10) 0.00811(13) Uani 1 2 d S T P
In In 0.0000 0.0000 0.0000 0.00945(15) Uani 0.969(2) 4 d S T .
Ge1 Ge 0.06576(3) 0.0000 0.65284(7) 0.00759(10) Uani 1 2 d S T P
Ge2 Ge 0.21179(3) 0.0000 0.27952(7) 0.00833(11) Uani 1 2 d S T P
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Fe Fe 0.3463 0.8444 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ge Ge 0.1547 1.8001 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
In In -0.7276 1.3100 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ce Ce -0.2486 2.6331 '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
Ge1 Ce1 Ge1 90.76(2) 7_556 7_546
Ge1 Ce1 Ge2 83.971(19) 7_556 .
Ge1 Ce1 Ge2 83.971(19) 7_546 .
Ge1 Ce1 Ge2 168.395(17) 7_556 7_545
Ge1 Ce1 Ge2 91.06(2) 7_546 7_545
Ge2 Ce1 Ge2 107.618(16) . 7_545
Ge1 Ce1 Ge2 91.06(2) 7_556 7
Ge1 Ce1 Ge2 168.395(17) 7_546 7
Ge2 Ce1 Ge2 107.618(17) . 7
Ge2 Ce1 Ge2 84.93(2) 7_545 7
Ge1 Ce1 Fe 134.619(11) 7_556 1_554
Ge1 Ce1 Fe 134.619(11) 7_546 1_554
Ge2 Ce1 Fe 98.52(2) . 1_554
Ge2 Ce1 Fe 44.753(12) 7_545 1_554
Ge2 Ce1 Fe 44.753(12) 7 1_554
Ge1 Ce1 In 55.312(15) 7_556 3
Ge1 Ce1 In 110.027(18) 7_546 3
Ge2 Ce1 In 135.922(10) . 3
Ge2 Ce1 In 113.436(16) 7_545 3
Ge2 Ce1 In 62.166(14) 7 3
Fe Ce1 In 99.344(16) 1_554 3
Ge1 Ce1 In 110.027(18) 7_556 3_545
Ge1 Ce1 In 55.313(15) 7_546 3_545
Ge2 Ce1 In 135.922(10) . 3_545
Ge2 Ce1 In 62.166(14) 7_545 3_545
Ge2 Ce1 In 113.436(16) 7 3_545
Fe Ce1 In 99.344(16) 1_554 3_545
In Ce1 In 79.634(19) 3 3_545
Ge1 Ce1 Fe 43.798(18) 7_556 7_556
Ge1 Ce1 Fe 99.05(2) 7_546 7_556
Ge2 Ce1 Fe 43.227(13) . 7_556
Ge2 Ce1 Fe 146.796(19) 7_545 7_556
Ge2 Ce1 Fe 90.17(2) 7 7_556
Fe Ce1 Fe 113.634(19) 1_554 7_556
In Ce1 Fe 92.724(16) 3 7_556
In Ce1 Fe 146.968(14) 3_545 7_556
Ge1 Ce1 Fe 99.05(2) 7_556 7_546
Ge1 Ce1 Fe 43.798(18) 7_546 7_546
Ge2 Ce1 Fe 43.227(13) . 7_546
Ge2 Ce1 Fe 90.17(2) 7_545 7_546
Ge2 Ce1 Fe 146.796(18) 7 7_546
Fe Ce1 Fe 113.634(19) 1_554 7_546
In Ce1 Fe 146.968(14) 3 7_546
In Ce1 Fe 92.724(16) 3_545 7_546
Fe Ce1 Fe 76.27(2) 7_556 7_546
Ge1 Ce1 Ce2 114.344(17) 7_556 5_655
Ge1 Ce1 Ce2 114.344(17) 7_546 5_655
Ge2 Ce1 Ce2 152.664(14) . 5_655
Ge2 Ce1 Ce2 54.704(14) 7_545 5_655
Ge2 Ce1 Ce2 54.704(14) 7 5_655
Fe Ce1 Ce2 54.14(2) 1_554 5_655
In Ce1 Ce2 59.113(7) 3 5_655
In Ce1 Ce2 59.113(7) 3_545 5_655
Fe Ce1 Ce2 141.564(11) 7_556 5_655
Fe Ce1 Ce2 141.564(11) 7_546 5_655
Ge1 Ce1 Ce1 139.783(17) 7_556 7_545
Ge1 Ce1 Ce1 85.951(16) 7_546 7_545
Ge2 Ce1 Ce1 55.815(15) . 7_545
Ge2 Ce1 Ce1 51.803(12) 7_545 7_545
Ge2 Ce1 Ce1 99.957(16) 7 7_545
Fe Ce1 Ce1 60.384(14) 1_554 7_545
In Ce1 Ce1 159.648(13) 3 7_545
In Ce1 Ce1 100.784(18) 3_545 7_545
Fe Ce1 Ce1 97.204(19) 7_556 7_545
Fe Ce1 Ce1 53.250(15) 7_546 7_545
Ce2 Ce1 Ce1 103.355(13) 5_655 7_545
Ge1 Ce2 Ge1 90.67(2) 3 3_545
Ge1 Ce2 Fe 108.325(14) 3 5_656
Ge1 Ce2 Fe 108.325(14) 3_545 5_656
Ge1 Ce2 Ge2 81.952(18) 3 3
Ge1 Ce2 Ge2 147.129(16) 3_545 3
Fe Ce2 Ge2 46.061(12) 5_656 3
Ge1 Ce2 Ge2 147.129(16) 3 3_545
Ge1 Ce2 Ge2 81.952(18) 3_545 3_545
Fe Ce2 Ge2 46.061(12) 5_656 3_545
Ge2 Ce2 Ge2 87.09(2) 3 3_545
Ge1 Ce2 Fe 47.030(19) 3 3
Ge1 Ce2 Fe 106.94(2) 3_545 3
Fe Ce2 Fe 61.366(19) 5_656 3
Ge2 Ce2 Fe 46.486(19) 3 3
Ge2 Ce2 Fe 104.71(2) 3_545 3
Ge1 Ce2 Fe 106.94(2) 3 3_545
Ge1 Ce2 Fe 47.030(19) 3_545 3_545
Fe Ce2 Fe 61.366(19) 5_656 3_545
Ge2 Ce2 Fe 104.71(2) 3 3_545
Ge2 Ce2 Fe 46.486(19) 3_545 3_545
Fe Ce2 Fe 86.33(2) 3 3_545
Ge1 Ce2 Ge1 106.405(15) 3 7_546
Ge1 Ce2 Ge1 48.172(18) 3_545 7_546
Fe Ce2 Ge1 137.887(12) 5_656 7_546
Ge2 Ce2 Ge1 163.918(16) 3 7_546
Ge2 Ce2 Ge1 92.37(2) 3_545 7_546
Fe Ce2 Ge1 147.985(19) 3 7_546
Fe Ce2 Ge1 86.26(2) 3_545 7_546
Ge1 Ce2 Ge1 48.172(18) 3 7_556
Ge1 Ce2 Ge1 106.405(15) 3_545 7_556
Fe Ce2 Ge1 137.887(12) 5_656 7_556
Ge2 Ce2 Ge1 92.37(2) 3 7_556
Ge2 Ce2 Ge1 163.918(16) 3_545 7_556
Fe Ce2 Ge1 86.26(2) 3 7_556
Fe Ce2 Ge1 147.985(19) 3_545 7_556
Ge1 Ce2 Ge1 83.74(2) 7_546 7_556
Ge1 Ce2 Ge2 77.634(16) 3 5_656
Ge1 Ce2 Ge2 77.634(17) 3_545 5_656
Fe Ce2 Ge2 44.30(2) 5_656 5_656
Ge2 Ce2 Ge2 69.500(18) 3 5_656
Ge2 Ce2 Ge2 69.500(18) 3_545 5_656
Fe Ce2 Ge2 43.362(12) 3 5_656
Fe Ce2 Ge2 43.362(12) 3_545 5_656
Ge1 Ce2 Ge2 125.200(15) 7_546 5_656
Ge1 Ce2 Ge2 125.200(15) 7_556 5_656
Ge1 Ce2 In 150.180(15) 3 3_545
Ge1 Ce2 In 88.49(2) 3_545 3_545
Fe Ce2 In 100.191(13) 5_656 3_545
Ge2 Ce2 In 113.390(17) 3 3_545
Ge2 Ce2 In 62.035(15) 3_545 3_545
Fe Ce2 In 158.628(16) 3 3_545
Fe Ce2 In 94.092(18) 3_545 3_545
Ge1 Ce2 In 53.123(13) 7_546 3_545
Ge1 Ce2 In 103.817(15) 7_556 3_545
Ge2 Ce2 In 130.969(10) 5_656 3_545
Ge1 Ce2 In 88.489(19) 3 3
Ge1 Ce2 In 150.180(15) 3_545 3
Fe Ce2 In 100.191(13) 5_656 3
Ge2 Ce2 In 62.035(15) 3 3
Ge2 Ce2 In 113.390(18) 3_545 3
Fe Ce2 In 94.092(18) 3 3
Fe Ce2 In 158.628(16) 3_545 3
Ge1 Ce2 In 103.817(15) 7_546 3
Ge1 Ce2 In 53.123(12) 7_556 3
Ge2 Ce2 In 130.969(10) 5_656 3
In Ce2 In 77.876(18) 3_545 3
Ge2 Fe Ge2 124.09(4) 7_556 7_546
Ge2 Fe Ge1 111.37(2) 7_556 .
Ge2 Fe Ge1 111.37(2) 7_546 .
Ge2 Fe Ge2 99.00(2) 7_556 .
Ge2 Fe Ge2 99.00(2) 7_546 .
Ge1 Fe Ge2 109.49(3) . .
Ge2 Fe Ce2 67.41(2) 7_556 5_656
Ge2 Fe Ce2 67.41(2) 7_546 5_656
Ge1 Fe Ce2 175.98(3) . 5_656
Ge2 Fe Ce2 74.53(2) . 5_656
Ge2 Fe Ce2 159.41(3) 7_556 3_445
Ge2 Fe Ce2 74.192(19) 7_546 3_445
Ge1 Fe Ce2 63.929(18) . 3_445
Ge2 Fe Ce2 66.289(18) . 3_445
Ce2 Fe Ce2 118.633(19) 5_656 3_445
Ge2 Fe Ce2 74.192(19) 7_556 3_455
Ge2 Fe Ce2 159.41(3) 7_546 3_455
Ge1 Fe Ce2 63.929(18) . 3_455
Ge2 Fe Ce2 66.289(18) . 3_455
Ce2 Fe Ce2 118.633(19) 5_656 3_455
Ce2 Fe Ce2 86.33(2) 3_445 3_455
Ge2 Fe Ce1 67.090(19) 7_556 1_556
Ge2 Fe Ce1 67.090(19) 7_546 1_556
Ge1 Fe Ce1 107.14(3) . 1_556
Ge2 Fe Ce1 143.37(3) . 1_556
Ce2 Fe Ce1 68.840(19) 5_656 1_556
Ce2 Fe Ce1 133.298(14) 3_445 1_556
Ce2 Fe Ce1 133.298(14) 3_455 1_556
Ge2 Fe Ce1 58.349(19) 7_556 7_556
Ge2 Fe Ce1 124.48(3) 7_546 7_556
Ge1 Fe Ce1 58.096(15) . 7_556
Ge2 Fe Ce1 136.510(16) . 7_556
Ce2 Fe Ce1 119.103(17) 5_656 7_556
Ce2 Fe Ce1 121.96(3) 3_445 7_556
Ce2 Fe Ce1 71.603(19) 3_455 7_556
Ce1 Fe Ce1 66.366(19) 1_556 7_556
Ge2 Fe Ce1 124.48(3) 7_556 7_546
Ge2 Fe Ce1 58.349(19) 7_546 7_546
Ge1 Fe Ce1 58.096(15) . 7_546
Ge2 Fe Ce1 136.510(16) . 7_546
Ce2 Fe Ce1 119.103(17) 5_656 7_546
Ce2 Fe Ce1 71.603(19) 3_445 7_546
Ce2 Fe Ce1 121.96(3) 3_455 7_546
Ce1 Fe Ce1 66.366(19) 1_556 7_546
Ce1 Fe Ce1 76.27(2) 7_556 7_546
Ge1 In Ge1 180.000(16) 5_556 1_554
Ge1 In Ce1 56.585(9) 5_556 3_445
Ge1 In Ce1 123.415(9) 1_554 3_445
Ge1 In Ce1 123.415(9) 5_556 7
Ge1 In Ce1 56.585(9) 1_554 7
Ce1 In Ce1 180.0 3_445 7
Ge1 In Ce1 123.415(9) 5_556 7_545
Ge1 In Ce1 56.585(9) 1_554 7_545
Ce1 In Ce1 100.366(19) 3_445 7_545
Ce1 In Ce1 79.634(19) 7 7_545
Ge1 In Ce1 56.585(9) 5_556 3_455
Ge1 In Ce1 123.415(9) 1_554 3_455
Ce1 In Ce1 79.634(19) 3_445 3_455
Ce1 In Ce1 100.366(19) 7 3_455
Ce1 In Ce1 180.0 7_545 3_455
Ge1 In Ce2 60.000(15) 5_556 3_455
Ge1 In Ce2 120.000(14) 1_554 3_455
Ce1 In Ce2 116.495(13) 3_445 3_455
Ce1 In Ce2 63.505(13) 7 3_455
Ce1 In Ce2 111.024(13) 7_545 3_455
Ce1 In Ce2 68.976(13) 3_455 3_455
Ge1 In Ce2 120.000(14) 5_556 7_545
Ge1 In Ce2 60.000(15) 1_554 7_545
Ce1 In Ce2 63.505(13) 3_445 7_545
Ce1 In Ce2 116.495(13) 7 7_545
Ce1 In Ce2 68.976(13) 7_545 7_545
Ce1 In Ce2 111.024(13) 3_455 7_545
Ce2 In Ce2 180.0 3_455 7_545
Ge1 In Ce2 60.000(15) 5_556 3_445
Ge1 In Ce2 120.000(14) 1_554 3_445
Ce1 In Ce2 68.976(13) 3_445 3_445
Ce1 In Ce2 111.024(13) 7 3_445
Ce1 In Ce2 63.505(13) 7_545 3_445
Ce1 In Ce2 116.495(13) 3_455 3_445
Ce2 In Ce2 77.876(19) 3_455 3_445
Ce2 In Ce2 102.124(18) 7_545 3_445
Ge1 In Ce2 120.000(14) 5_556 7
Ge1 In Ce2 60.000(15) 1_554 7
Ce1 In Ce2 111.024(13) 3_445 7
Ce1 In Ce2 68.976(13) 7 7
Ce1 In Ce2 116.495(13) 7_545 7
Ce1 In Ce2 63.505(13) 3_455 7
Ce2 In Ce2 102.124(18) 3_455 7
Ce2 In Ce2 77.876(19) 7_545 7
Ce2 In Ce2 180.0 3_445 7
Fe Ge1 Ge1 120.27(4) . 5_556
Fe Ge1 In 130.87(2) . 1_556
Ge1 Ge1 In 108.86(3) 5_556 1_556
Fe Ge1 Ce1 78.107(18) . 7_556
Ge1 Ge1 Ce1 133.142(13) 5_556 7_556
In Ge1 Ce1 68.103(16) 1_556 7_556
Fe Ge1 Ce1 78.107(18) . 7_546
Ge1 Ge1 Ce1 133.142(13) 5_556 7_546
In Ge1 Ce1 68.103(16) 1_556 7_546
Ce1 Ge1 Ce1 90.76(2) 7_556 7_546
Fe Ge1 Ce2 69.042(16) . 3_445
Ge1 Ge1 Ce2 69.98(2) 5_556 3_445
In Ge1 Ce2 133.764(12) 1_556 3_445
Ce1 Ge1 Ce2 147.02(2) 7_556 3_445
Ce1 Ge1 Ce2 80.004(19) 7_546 3_445
Fe Ge1 Ce2 69.042(16) . 3_455
Ge1 Ge1 Ce2 69.98(2) 5_556 3_455
In Ge1 Ce2 133.764(12) 1_556 3_455
Ce1 Ge1 Ce2 80.004(19) 7_556 3_455
Ce1 Ge1 Ce2 147.02(2) 7_546 3_455
Ce2 Ge1 Ce2 90.67(2) 3_445 3_455
Fe Ge1 Ce2 137.344(13) . 7_546
Ge1 Ge1 Ce2 61.849(18) 5_556 7_546
In Ge1 Ce2 66.877(13) 1_556 7_546
Ce1 Ge1 Ce2 134.85(2) 7_556 7_546
Ce1 Ge1 Ce2 75.823(16) 7_546 7_546
Ce2 Ge1 Ce2 73.595(15) 3_445 7_546
Ce2 Ge1 Ce2 131.828(17) 3_455 7_546
Fe Ge1 Ce2 137.344(12) . 7_556
Ge1 Ge1 Ce2 61.849(18) 5_556 7_556
In Ge1 Ce2 66.877(13) 1_556 7_556
Ce1 Ge1 Ce2 75.823(16) 7_556 7_556
Ce1 Ge1 Ce2 134.85(2) 7_546 7_556
Ce2 Ge1 Ce2 131.828(17) 3_445 7_556
Ce2 Ge1 Ce2 73.595(15) 3_455 7_556
Ce2 Ge1 Ce2 83.73(2) 7_546 7_556
Fe Ge2 Fe 124.09(4) 7_556 7_546
Fe Ge2 Fe 81.00(2) 7_556 .
Fe Ge2 Fe 81.00(2) 7_546 .
Fe Ge2 Ce1 78.42(2) 7_556 .
Fe Ge2 Ce1 78.42(2) 7_546 .
Fe Ge2 Ce1 135.15(3) . .
Fe Ge2 Ce2 144.96(3) 7_556 3_445
Fe Ge2 Ce2 66.53(2) 7_546 3_445
Fe Ge2 Ce2 67.224(16) . 3_445
Ce1 Ge2 Ce2 134.962(12) . 3_445
Fe Ge2 Ce2 66.53(2) 7_556 3_455
Fe Ge2 Ce2 144.96(3) 7_546 3_455
Fe Ge2 Ce2 67.224(16) . 3_455
Ce1 Ge2 Ce2 134.962(12) . 3_455
Ce2 Ge2 Ce2 87.09(2) 3_445 3_455
Fe Ge2 Ce1 145.15(3) 7_556 7_545
Fe Ge2 Ce1 68.16(2) 7_546 7_545
Fe Ge2 Ce1 133.552(15) . 7_545
Ce1 Ge2 Ce1 72.381(17) . 7_545
Ce2 Ge2 Ce1 68.909(16) 3_445 7_545
Ce2 Ge2 Ce1 124.78(2) 3_455 7_545
Fe Ge2 Ce1 68.16(2) 7_556 7
Fe Ge2 Ce1 145.15(3) 7_546 7
Fe Ge2 Ce1 133.552(15) . 7
Ce1 Ge2 Ce1 72.381(16) . 7
Ce2 Ge2 Ce1 124.78(2) 3_445 7
Ce2 Ge2 Ce1 68.909(15) 3_455 7
Ce1 Ge2 Ce1 84.93(2) 7_545 7
Fe Ge2 Ce2 62.444(19) 7_556 5_656
Fe Ge2 Ce2 62.444(19) 7_546 5_656
Fe Ge2 Ce2 61.17(2) . 5_656
Ce1 Ge2 Ce2 73.98(2) . 5_656
Ce2 Ge2 Ce2 110.499(18) 3_445 5_656
Ce2 Ge2 Ce2 110.499(18) 3_455 5_656
Ce1 Ge2 Ce2 124.269(14) 7_545 5_656
Ce1 Ge2 Ce2 124.269(14) 7 5_656
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ce1 Ge1 3.0543(6) 7_556
Ce1 Ge1 3.0543(6) 7_546
Ce1 Ge2 3.0591(8) .
Ce1 Ge2 3.2200(7) 7_545
Ce1 Ge2 3.2200(7) 7
Ce1 Fe 3.2448(9) 1_554
Ce1 In 3.3951(6) 3
Ce1 In 3.3951(6) 3_545
Ce1 Fe 3.5205(8) 7_556
Ce1 Fe 3.5205(8) 7_546
Ce1 Ce2 3.6075(8) 5_655
Ce1 Ce1 3.7099(8) 7_545
Ce2 Ge1 3.0568(6) 3
Ce2 Ge1 3.0568(6) 3_545
Ce2 Fe 3.1351(11) 5_656
Ce2 Ge2 3.1558(6) 3
Ce2 Ge2 3.1558(6) 3_545
Ce2 Fe 3.1780(7) 3
Ce2 Fe 3.1780(7) 3_545
Ce2 Ge1 3.2574(7) 7_546
Ce2 Ge1 3.2574(7) 7_556
Ce2 Ge2 3.4490(8) 5_656
Ce2 In 3.4591(6) 3_545
Ce2 In 3.4591(6) 3
Fe Ge2 2.4612(6) 7_556
Fe Ge2 2.4612(6) 7_546
Fe Ge1 2.4900(10) .
Fe Ge2 2.4996(10) .
Fe Ce2 3.1352(10) 5_656
Fe Ce2 3.1779(7) 3_445
Fe Ce2 3.1779(7) 3_455
Fe Ce1 3.2448(9) 1_556
Fe Ce1 3.5205(8) 7_556
Fe Ce1 3.5205(8) 7_546
In Ge1 3.0088(8) 5_556
In Ge1 3.0088(8) 1_554
In Ce1 3.3951(6) 3_445
In Ce1 3.3951(6) 7
In Ce1 3.3951(6) 7_545
In Ce1 3.3951(6) 3_455
In Ce2 3.4591(6) 3_455
In Ce2 3.4591(6) 7_545
In Ce2 3.4591(6) 3_445
In Ce2 3.4591(6) 7
Ge1 Ge1 2.5834(10) 5_556
Ge1 In 3.0088(8) 1_556
Ge1 Ce1 3.0543(6) 7_556
Ge1 Ce1 3.0543(6) 7_546
Ge1 Ce2 3.0568(6) 3_445
Ge1 Ce2 3.0568(6) 3_455
Ge1 Ce2 3.2574(7) 7_546
Ge1 Ce2 3.2574(7) 7_556
Ge2 Fe 2.4612(6) 7_556
Ge2 Fe 2.4612(6) 7_546
Ge2 Ce2 3.1557(6) 3_445
Ge2 Ce2 3.1557(6) 3_455
Ge2 Ce1 3.2200(7) 7_545
Ge2 Ce1 3.2200(7) 7
Ge2 Ce2 3.4490(8) 5_656
