#------------------------------------------------------------------------------
#$Date: 2019-11-17 05:03:17 +0200 (Sun, 17 Nov 2019) $
#$Revision: 228016 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/12/18/7121800.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_7121800
loop_
_publ_author_name
'Ovchinnikov, Alexander'
'Makongo, Julien P. A.'
'Bobev, Svilen'
_publ_section_title
;
 Yet again, new compounds found in systems with known binary phase
 diagrams. Synthesis, crystal and electronic structure of
 Nd₃Bi₇ and Sm₃Bi₇.
;
_journal_issue                   51
_journal_name_full
'Chemical communications (Cambridge, England)'
_journal_page_first              7089
_journal_page_last               7092
_journal_paper_doi               10.1039/c8cc02563k
_journal_volume                  54
_journal_year                    2018
_chemical_formula_sum            'Bi7 Sm3'
_chemical_formula_weight         1913.91
_space_group_crystal_system      orthorhombic
_space_group_IT_number           71
_space_group_name_Hall           '-I 2 2'
_space_group_name_H-M_alt        'I m m m'
_symmetry_space_group_name_Hall  '-I 2 2'
_symmetry_space_group_name_H-M   'I m m m'
_audit_creation_method           SHELXL-2014/7
_audit_update_record
;
2018-03-27 deposited with the CCDC.
2018-06-04 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   4.2762(8)
_cell_length_b                   15.050(3)
_cell_length_c                   19.034(4)
_cell_measurement_reflns_used    367
_cell_measurement_temperature    200(2)
_cell_measurement_theta_max      28.03
_cell_measurement_theta_min      3.45
_cell_volume                     1225.0(4)
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker APEX2'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_computing_structure_solution    'Bruker SHELXTL'
_diffrn_ambient_temperature      200(2)
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.996
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0517
_diffrn_reflns_av_unetI/netI     0.0727
_diffrn_reflns_Laue_measured_fraction_full 0.997
_diffrn_reflns_Laue_measured_fraction_max 0.996
_diffrn_reflns_limit_h_max       5
_diffrn_reflns_limit_h_min       -5
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -20
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_limit_l_min       -25
_diffrn_reflns_number            2557
_diffrn_reflns_point_group_measured_fraction_full 0.997
_diffrn_reflns_point_group_measured_fraction_max 0.996
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         28.420
_diffrn_reflns_theta_min         1.725
_diffrn_source                   'sealed tube'
_exptl_absorpt_coefficient_mu    114.224
_exptl_absorpt_correction_T_max  0.048
_exptl_absorpt_correction_T_min  0.011
_exptl_absorpt_correction_type   multi-scan
_exptl_crystal_colour            black
_exptl_crystal_density_diffrn    10.378
_exptl_crystal_description       block
_exptl_crystal_F_000             3068
_exptl_crystal_size_max          0.080
_exptl_crystal_size_mid          0.060
_exptl_crystal_size_min          0.040
_refine_diff_density_max         3.039
_refine_diff_density_min         -4.512
_refine_diff_density_rms         0.864
_refine_ls_extinction_coef       0.000090(15)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     'SHELXL-2014/7 (Sheldrick 2014'
_refine_ls_goodness_of_fit_ref   1.001
_refine_ls_hydrogen_treatment    undef
_refine_ls_matrix_type           full
_refine_ls_number_parameters     38
_refine_ls_number_reflns         931
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.001
_refine_ls_R_factor_all          0.0580
_refine_ls_R_factor_gt           0.0426
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0221P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0857
_refine_ls_wR_factor_ref         0.0924
_reflns_Friedel_coverage         0.000
_reflns_number_gt                701
_reflns_number_total             931
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            c8cc02563k2.cif
_cod_data_source_block           shelx_CCDC1
_cod_depositor_comments
;
The following automatic conversions were performed:

'_exptl_absorpt_correction_type' value 'Multi-scan' changed to
'multi-scan' according to
/home/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 4973 2017-02-22 13:04:09Z antanas 

 Adding full bibliography for 7121799--7121800.cif.
;
_cod_database_code               7121800
_shelx_shelxl_version_number     2014/7
_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   0.039
_shelx_estimated_absorpt_t_max   0.092
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, z'
'x, -y, -z'
'-x, y, -z'
'x+1/2, y+1/2, z+1/2'
'-x+1/2, -y+1/2, z+1/2'
'x+1/2, -y+1/2, -z+1/2'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, y, -z'
'-x, y, z'
'x, -y, z'
'-x+1/2, -y+1/2, -z+1/2'
'x+1/2, y+1/2, -z+1/2'
'-x+1/2, y+1/2, z+1/2'
'x+1/2, -y+1/2, z+1/2'
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
Sm1 Sm 0.0000 0.13886(8) 0.36812(8) 0.0156(3) Uani 1 2 d S T P
Sm2 Sm 0.0000 0.0000 0.17310(10) 0.0145(4) Uani 1 4 d S T P
Bi1 Bi 0.0000 0.21180(6) 0.19686(5) 0.0154(3) Uani 1 2 d S T P
Bi2 Bi 0.0000 0.36056(6) 0.41167(6) 0.0179(3) Uani 1 2 d S T P
Bi3 Bi 0.5000 0.0000 0.30095(7) 0.0152(3) Uani 1 4 d S T P
Bi4 Bi 0.0000 0.33396(9) 0.0000 0.0170(3) Uani 1 4 d S T P
Bi5 Bi 0.5000 0.5000 0.0000 0.0168(4) Uani 1 8 d S T P
Bi6 Bi 0.0000 0.0000 0.0000 0.0195(4) Uani 1 8 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
Bi Bi -4.1077 10.2566 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Sm Sm -0.1638 3.4418 '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
Bi3 Sm1 Bi3 82.22(4) . 1_455
Bi3 Sm1 Bi5 83.74(4) . 5_445
Bi3 Sm1 Bi5 83.74(4) 1_455 5_445
Bi3 Sm1 Bi4 87.31(3) . 13
Bi3 Sm1 Bi4 143.07(5) 1_455 13
Bi5 Sm1 Bi4 59.88(3) 5_445 13
Bi3 Sm1 Bi4 143.07(5) . 13_455
Bi3 Sm1 Bi4 87.31(3) 1_455 13_455
Bi5 Sm1 Bi4 59.88(3) 5_445 13_455
Bi4 Sm1 Bi4 80.11(4) 13 13_455
Bi3 Sm1 Bi1 82.29(3) . 13
Bi3 Sm1 Bi1 135.06(5) 1_455 13
Bi5 Sm1 Bi1 135.66(3) 5_445 13
Bi4 Sm1 Bi1 77.58(3) 13 13
Bi4 Sm1 Bi1 127.51(5) 13_455 13
Bi3 Sm1 Bi1 135.06(5) . 13_455
Bi3 Sm1 Bi1 82.29(3) 1_455 13_455
Bi5 Sm1 Bi1 135.66(3) 5_445 13_455
Bi4 Sm1 Bi1 127.51(5) 13 13_455
Bi4 Sm1 Bi1 77.58(3) 13_455 13_455
Bi1 Sm1 Bi1 79.62(4) 13 13_455
Bi3 Sm1 Bi2 135.93(2) . .
Bi3 Sm1 Bi2 135.93(2) 1_455 .
Bi5 Sm1 Bi2 115.83(5) 5_445 .
Bi4 Sm1 Bi2 72.44(4) 13 .
Bi4 Sm1 Bi2 72.44(4) 13_455 .
Bi1 Sm1 Bi2 55.68(3) 13 .
Bi1 Sm1 Bi2 55.68(3) 13_455 .
Bi3 Sm1 Bi1 80.35(4) . .
Bi3 Sm1 Bi1 80.35(4) 1_455 .
Bi5 Sm1 Bi1 158.83(5) 5_445 .
Bi4 Sm1 Bi1 132.58(3) 13 .
Bi4 Sm1 Bi1 132.58(3) 13_455 .
Bi1 Sm1 Bi1 55.54(3) 13 .
Bi1 Sm1 Bi1 55.54(3) 13_455 .
Bi2 Sm1 Bi1 85.34(4) . .
Bi1 Sm2 Bi1 163.86(8) 2 .
Bi1 Sm2 Bi3 83.95(3) 2 1_455
Bi1 Sm2 Bi3 83.94(3) . 1_455
Bi1 Sm2 Bi3 83.95(3) 2 .
Bi1 Sm2 Bi3 83.94(3) . .
Bi3 Sm2 Bi3 82.61(6) 1_455 .
Bi1 Sm2 Bi6 98.07(4) 2 .
Bi1 Sm2 Bi6 98.07(4) . .
Bi3 Sm2 Bi6 138.69(3) 1_455 .
Bi3 Sm2 Bi6 138.70(3) . .
Bi1 Sm2 Bi2 57.04(2) 2 14_445
Bi1 Sm2 Bi2 132.63(3) . 14_445
Bi3 Sm2 Bi2 86.64(2) 1_455 14_445
Bi3 Sm2 Bi2 140.44(3) . 14_445
Bi6 Sm2 Bi2 61.69(3) . 14_445
Bi1 Sm2 Bi2 132.63(3) 2 13
Bi1 Sm2 Bi2 57.04(2) . 13
Bi3 Sm2 Bi2 140.44(3) 1_455 13
Bi3 Sm2 Bi2 86.64(2) . 13
Bi6 Sm2 Bi2 61.69(3) . 13
Bi2 Sm2 Bi2 123.39(7) 14_445 13
Bi1 Sm2 Bi2 132.63(3) 2 13_455
Bi1 Sm2 Bi2 57.04(2) . 13_455
Bi3 Sm2 Bi2 86.64(2) 1_455 13_455
Bi3 Sm2 Bi2 140.44(3) . 13_455
Bi6 Sm2 Bi2 61.69(3) . 13_455
Bi2 Sm2 Bi2 76.16(4) 14_445 13_455
Bi2 Sm2 Bi2 77.85(4) 13 13_455
Bi1 Sm2 Bi2 57.04(2) 2 14_545
Bi1 Sm2 Bi2 132.63(3) . 14_545
Bi3 Sm2 Bi2 140.44(3) 1_455 14_545
Bi3 Sm2 Bi2 86.64(2) . 14_545
Bi6 Sm2 Bi2 61.69(3) . 14_545
Bi2 Sm2 Bi2 77.85(4) 14_445 14_545
Bi2 Sm2 Bi2 76.16(4) 13 14_545
Bi2 Sm2 Bi2 123.39(7) 13_455 14_545
Bi1 Bi1 Bi1 85.15(5) 13 13_455
Bi1 Bi1 Bi2 178.66(6) 13 13_455
Bi1 Bi1 Bi2 94.93(2) 13_455 13_455
Bi1 Bi1 Bi2 94.93(2) 13 13
Bi1 Bi1 Bi2 178.66(6) 13_455 13
Bi2 Bi1 Bi2 84.96(4) 13_455 13
Bi1 Bi1 Sm2 116.75(4) 13 .
Bi1 Bi1 Sm2 116.75(4) 13_455 .
Bi2 Bi1 Sm2 64.40(3) 13_455 .
Bi2 Bi1 Sm2 64.40(3) 13 .
Bi1 Bi1 Sm1 63.84(3) 13 13
Bi1 Bi1 Sm1 115.18(5) 13_455 13
Bi2 Bi1 Sm1 114.97(4) 13_455 13
Bi2 Bi1 Sm1 63.74(3) 13 13
Sm2 Bi1 Sm1 127.90(4) . 13
Bi1 Bi1 Sm1 115.18(5) 13 13_455
Bi1 Bi1 Sm1 63.84(3) 13_455 13_455
Bi2 Bi1 Sm1 63.74(3) 13_455 13_455
Bi2 Bi1 Sm1 114.97(4) 13 13_455
Sm2 Bi1 Sm1 127.90(4) . 13_455
Sm1 Bi1 Sm1 79.62(4) 13 13_455
Bi1 Bi1 Sm1 60.62(4) 13 .
Bi1 Bi1 Sm1 60.62(4) 13_455 .
Bi2 Bi1 Sm1 120.57(3) 13_455 .
Bi2 Bi1 Sm1 120.57(3) 13 .
Sm2 Bi1 Sm1 79.46(5) . .
Sm1 Bi1 Sm1 124.46(3) 13 .
Sm1 Bi1 Sm1 124.46(3) 13_455 .
Bi1 Bi2 Bi1 84.96(4) 13_455 13
Bi1 Bi2 Bi2 130.72(2) 13_455 10_556
Bi1 Bi2 Bi2 130.72(2) 13 10_556
Bi1 Bi2 Sm2 109.09(5) 13_455 13
Bi1 Bi2 Sm2 58.56(3) 13 13
Bi2 Bi2 Sm2 118.31(3) 10_556 13
Bi1 Bi2 Sm2 58.56(3) 13_455 13_455
Bi1 Bi2 Sm2 109.09(5) 13 13_455
Bi2 Bi2 Sm2 118.31(3) 10_556 13_455
Sm2 Bi2 Sm2 77.86(4) 13 13_455
Bi1 Bi2 Bi6 161.75(4) 13_455 5
Bi1 Bi2 Bi6 96.264(19) 13 5
Bi2 Bi2 Bi6 60.699(18) 10_556 5
Sm2 Bi2 Bi6 57.61(3) 13 5
Sm2 Bi2 Bi6 104.26(3) 13_455 5
Bi1 Bi2 Bi6 96.264(19) 13_455 5_455
Bi1 Bi2 Bi6 161.75(4) 13 5_455
Bi2 Bi2 Bi6 60.699(18) 10_556 5_455
Sm2 Bi2 Bi6 104.26(3) 13 5_455
Sm2 Bi2 Bi6 57.61(3) 13_455 5_455
Bi6 Bi2 Bi6 76.98(2) 5 5_455
Bi1 Bi2 Sm1 60.59(3) 13_455 .
Bi1 Bi2 Sm1 60.59(3) 13 .
Bi2 Bi2 Sm1 103.95(3) 10_556 .
Sm2 Bi2 Sm1 118.96(3) 13 .
Sm2 Bi2 Sm1 118.96(3) 13_455 .
Bi6 Bi2 Sm1 135.30(2) 5 .
Bi6 Bi2 Sm1 135.30(2) 5_455 .
Sm2 Bi3 Sm2 82.61(6) . 1_655
Sm2 Bi3 Sm1 82.03(3) . .
Sm2 Bi3 Sm1 136.84(3) 1_655 .
Sm2 Bi3 Sm1 136.84(3) . 1_655
Sm2 Bi3 Sm1 82.03(3) 1_655 1_655
Sm1 Bi3 Sm1 82.22(4) . 1_655
Sm2 Bi3 Sm1 82.03(3) . 2
Sm2 Bi3 Sm1 136.84(3) 1_655 2
Sm1 Bi3 Sm1 79.98(4) . 2
Sm1 Bi3 Sm1 133.69(7) 1_655 2
Sm2 Bi3 Sm1 136.84(3) . 2_655
Sm2 Bi3 Sm1 82.03(3) 1_655 2_655
Sm1 Bi3 Sm1 133.69(7) . 2_655
Sm1 Bi3 Sm1 79.98(4) 1_655 2_655
Sm1 Bi3 Sm1 82.22(4) 2 2_655
Bi5 Bi4 Bi5 81.10(4) . 1_455
Bi5 Bi4 Sm1 59.21(2) . 13
Bi5 Bi4 Sm1 108.95(4) 1_455 13
Bi5 Bi4 Sm1 108.95(4) . 6_454
Bi5 Bi4 Sm1 59.21(2) 1_455 6_454
Sm1 Bi4 Sm1 165.86(6) 13 6_454
Bi5 Bi4 Sm1 108.95(4) . 13_455
Bi5 Bi4 Sm1 59.21(2) 1_455 13_455
Sm1 Bi4 Sm1 80.11(4) 13 13_455
Sm1 Bi4 Sm1 98.13(4) 6_454 13_455
Bi5 Bi4 Sm1 59.21(2) . 6_554
Bi5 Bi4 Sm1 108.95(4) 1_455 6_554
Sm1 Bi4 Sm1 98.13(4) 13 6_554
Sm1 Bi4 Sm1 80.11(4) 6_454 6_554
Sm1 Bi4 Sm1 165.86(6) 13_455 6_554
Sm1 Bi5 Sm1 180.00(3) 14 6_554
Sm1 Bi5 Sm1 100.44(5) 14 5_554
Sm1 Bi5 Sm1 79.56(5) 6_554 5_554
Sm1 Bi5 Sm1 79.56(5) 14 13
Sm1 Bi5 Sm1 100.44(5) 6_554 13
Sm1 Bi5 Sm1 180.00(5) 5_554 13
Sm1 Bi5 Bi4 119.09(2) 14 .
Sm1 Bi5 Bi4 60.91(2) 6_554 .
Sm1 Bi5 Bi4 119.09(2) 5_554 .
Sm1 Bi5 Bi4 60.91(2) 13 .
Sm1 Bi5 Bi4 60.91(2) 14 9_665
Sm1 Bi5 Bi4 119.09(2) 6_554 9_665
Sm1 Bi5 Bi4 60.91(2) 5_554 9_665
Sm1 Bi5 Bi4 119.09(2) 13 9_665
Bi4 Bi5 Bi4 180.0 . 9_665
Sm1 Bi5 Bi4 119.09(2) 14 1_655
Sm1 Bi5 Bi4 60.91(2) 6_554 1_655
Sm1 Bi5 Bi4 119.09(2) 5_554 1_655
Sm1 Bi5 Bi4 60.91(2) 13 1_655
Bi4 Bi5 Bi4 81.10(4) . 1_655
Bi4 Bi5 Bi4 98.90(4) 9_665 1_655
Sm1 Bi5 Bi4 60.91(2) 14 9_565
Sm1 Bi5 Bi4 119.09(2) 6_554 9_565
Sm1 Bi5 Bi4 60.91(2) 5_554 9_565
Sm1 Bi5 Bi4 119.09(2) 13 9_565
Bi4 Bi5 Bi4 98.90(4) . 9_565
Bi4 Bi5 Bi4 81.10(4) 9_665 9_565
Bi4 Bi5 Bi4 180.0 1_655 9_565
Sm2 Bi6 Sm2 180.0 9 .
Sm2 Bi6 Bi2 119.302(18) 9 13
Sm2 Bi6 Bi2 60.698(18) . 13
Sm2 Bi6 Bi2 60.698(18) 9 5_444
Sm2 Bi6 Bi2 119.302(18) . 5_444
Bi2 Bi6 Bi2 180.00(4) 13 5_444
Sm2 Bi6 Bi2 119.301(18) 9 14_445
Sm2 Bi6 Bi2 60.699(18) . 14_445
Bi2 Bi6 Bi2 121.40(4) 13 14_445
Bi2 Bi6 Bi2 58.60(4) 5_444 14_445
Sm2 Bi6 Bi2 60.699(18) 9 6_554
Sm2 Bi6 Bi2 119.301(18) . 6_554
Bi2 Bi6 Bi2 58.60(4) 13 6_554
Bi2 Bi6 Bi2 121.40(4) 5_444 6_554
Bi2 Bi6 Bi2 180.00(4) 14_445 6_554
Sm2 Bi6 Bi2 119.302(18) 9 14_545
Sm2 Bi6 Bi2 60.698(18) . 14_545
Bi2 Bi6 Bi2 75.30(3) 13 14_545
Bi2 Bi6 Bi2 104.70(3) 5_444 14_545
Bi2 Bi6 Bi2 76.98(3) 14_445 14_545
Bi2 Bi6 Bi2 103.02(3) 6_554 14_545
Sm2 Bi6 Bi2 60.698(18) 9 6_454
Sm2 Bi6 Bi2 119.302(18) . 6_454
Bi2 Bi6 Bi2 104.70(3) 13 6_454
Bi2 Bi6 Bi2 75.30(3) 5_444 6_454
Bi2 Bi6 Bi2 103.02(3) 14_445 6_454
Bi2 Bi6 Bi2 76.98(3) 6_554 6_454
Bi2 Bi6 Bi2 180.00(4) 14_545 6_454
Sm2 Bi6 Bi2 60.698(18) 9 5_544
Sm2 Bi6 Bi2 119.302(18) . 5_544
Bi2 Bi6 Bi2 103.02(3) 13 5_544
Bi2 Bi6 Bi2 76.98(3) 5_444 5_544
Bi2 Bi6 Bi2 104.70(3) 14_445 5_544
Bi2 Bi6 Bi2 75.30(3) 6_554 5_544
Bi2 Bi6 Bi2 58.60(4) 14_545 5_544
Bi2 Bi6 Bi2 121.40(4) 6_454 5_544
Sm2 Bi6 Bi2 119.302(18) 9 13_455
Sm2 Bi6 Bi2 60.698(18) . 13_455
Bi2 Bi6 Bi2 76.98(3) 13 13_455
Bi2 Bi6 Bi2 103.02(3) 5_444 13_455
Bi2 Bi6 Bi2 75.30(3) 14_445 13_455
Bi2 Bi6 Bi2 104.70(3) 6_554 13_455
Bi2 Bi6 Bi2 121.40(4) 14_545 13_455
Bi2 Bi6 Bi2 58.60(4) 6_454 13_455
Bi2 Bi6 Bi2 180.00(4) 5_544 13_455
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Sm1 Bi3 3.2518(12) .
Sm1 Bi3 3.2518(12) 1_455
Sm1 Bi5 3.2662(14) 5_445
Sm1 Bi4 3.3226(12) 13
Sm1 Bi4 3.3226(12) 13_455
Sm1 Bi1 3.3396(13) 13
Sm1 Bi1 3.3396(13) 13_455
Sm1 Bi2 3.4379(17) .
Sm1 Bi1 3.4398(18) .
Sm2 Bi1 3.2195(12) 2
Sm2 Bi1 3.2195(12) .
Sm2 Bi3 3.2392(18) 1_455
Sm2 Bi3 3.2392(18) .
Sm2 Bi6 3.295(2) .
Sm2 Bi2 3.4028(13) 14_445
Sm2 Bi2 3.4028(13) 13
Sm2 Bi2 3.4028(13) 13_455
Sm2 Bi2 3.4028(13) 14_545
Bi1 Bi1 3.1601(15) 13
Bi1 Bi1 3.1601(15) 13_455
Bi1 Bi2 3.1661(11) 13_455
Bi1 Bi2 3.1661(11) 13
Bi1 Sm1 3.3395(13) 13
Bi1 Sm1 3.3395(13) 13_455
Bi2 Bi1 3.1661(11) 13_455
Bi2 Bi1 3.1661(11) 13
Bi2 Bi2 3.363(2) 10_556
Bi2 Sm2 3.4028(13) 13
Bi2 Sm2 3.4028(13) 13_455
Bi2 Bi6 3.4354(9) 5
Bi2 Bi6 3.4354(9) 5_455
Bi3 Sm2 3.2392(18) 1_655
Bi3 Sm1 3.2518(12) 1_655
Bi3 Sm1 3.2518(12) 2
Bi3 Sm1 3.2518(12) 2_655
Bi4 Bi5 3.2888(12) .
Bi4 Bi5 3.2888(12) 1_455
Bi4 Sm1 3.3226(12) 13
Bi4 Sm1 3.3226(12) 6_454
Bi4 Sm1 3.3226(12) 13_455
Bi4 Sm1 3.3226(12) 6_554
Bi5 Sm1 3.2662(14) 14
Bi5 Sm1 3.2662(14) 6_554
Bi5 Sm1 3.2662(14) 5_554
Bi5 Sm1 3.2662(14) 13
Bi5 Bi4 3.2888(12) 9_665
Bi5 Bi4 3.2888(12) 1_655
Bi5 Bi4 3.2888(12) 9_565
Bi6 Sm2 3.295(2) 9
Bi6 Bi2 3.4355(9) 13
Bi6 Bi2 3.4355(9) 5_444
Bi6 Bi2 3.4355(9) 14_445
Bi6 Bi2 3.4355(9) 6_554
Bi6 Bi2 3.4355(9) 14_545
Bi6 Bi2 3.4355(9) 6_454
Bi6 Bi2 3.4355(9) 5_544
Bi6 Bi2 3.4355(9) 13_455
