#------------------------------------------------------------------------------ #$Date: 2013-12-28 13:58:47 +0000 (Sat, 28 Dec 2013) $ #$Revision: 91933 $ #$URL: svn://www.crystallography.net/cod/cif/2/01/12/2011298.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/. The original data for this entry # were provided by IUCr Journals, http://journals.iucr.org/. # # The file may be used within the scientific community so long as # proper attribution is given to the journal article from which the # data were obtained. # data_2011298 loop_ _publ_author_name 'Barbier, Jacques' 'Park, Hyunsoo' _publ_section_title ; A new orthoborate, Sr~3~Ga~3~(BO~3~)~4~O(OH) ; _journal_issue 9 _journal_name_full 'Acta Crystallographica Section C' _journal_page_first 1057 _journal_page_last 1058 _journal_volume 56 _journal_year 2000 _chemical_formula_analytical 'B4 Ga3 H O14 Sr3' _chemical_formula_moiety 'Sr3 Ga3 (BO3 )4 O(OH)' _chemical_formula_structural 'B4 Ga3 H O14 Sr3' _chemical_formula_sum 'B4 Ga3 H O14 Sr3' _chemical_formula_weight 740.27 _chemical_name_common 'strontium gallium borate hydroxide' _space_group_IT_number 11 _symmetry_cell_setting monoclinic _symmetry_space_group_name_Hall '-P 2yb' _symmetry_space_group_name_H-M 'P 1 21/m 1' _audit_creation_method SHELXL _cell_angle_alpha 90.00 _cell_angle_beta 105.4140(10) _cell_angle_gamma 90.00 _cell_formula_units_Z 2 _cell_length_a 4.9084(2) _cell_length_b 13.6795(7) _cell_length_c 9.0482(4) _cell_measurement_reflns_used 15160 _cell_measurement_temperature 299(2) _cell_measurement_theta_max 36.37 _cell_measurement_theta_min 2.33 _cell_volume 585.68(5) _computing_cell_refinement 'SAINT (Siemens, 1996)' _computing_data_collection 'SMART (Siemens, 1996)' _computing_data_reduction SAINT _computing_molecular_graphics 'XTALDRAW (Bartelmehs & Downs, 1997)' _computing_publication_material SHELXL93 _computing_structure_refinement 'SHELXL93 (Sheldrick, 1993)' _computing_structure_solution 'SHELXS86 (Sheldrick, 1990)' _diffrn_ambient_temperature 299(2) _diffrn_detector_area_resol_mean 819.2 _diffrn_measurement_device 'Siemens SMART 1K CCD area detector + Siemens P4 diffractometer' _diffrn_measurement_method 'area detector' _diffrn_radiation_monochromator graphite _diffrn_radiation_source 'rotating anode' _diffrn_radiation_type MoK\a _diffrn_radiation_wavelength .71073 _diffrn_reflns_av_R_equivalents .0498 _diffrn_reflns_av_sigmaI/netI .0420 _diffrn_reflns_limit_h_max 8 _diffrn_reflns_limit_h_min -8 _diffrn_reflns_limit_k_max 22 _diffrn_reflns_limit_k_min -18 _diffrn_reflns_limit_l_max 14 _diffrn_reflns_limit_l_min -15 _diffrn_reflns_number 15160 _diffrn_reflns_theta_max 36.37 _diffrn_reflns_theta_min 2.33 _exptl_absorpt_coefficient_mu 20.449 _exptl_absorpt_correction_T_max .360 _exptl_absorpt_correction_T_min .161 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_process_details '(Sheldrick, 1996)' _exptl_crystal_colour colourless _exptl_crystal_density_diffrn 4.198 _exptl_crystal_density_meas 'not measured' _exptl_crystal_description prism _exptl_crystal_F_000 680 _exptl_crystal_size_max .09 _exptl_crystal_size_mid .08 _exptl_crystal_size_min .05 _refine_diff_density_max .998 _refine_diff_density_min -1.852 _refine_ls_extinction_method none _refine_ls_goodness_of_fit_all 1.055 _refine_ls_goodness_of_fit_ref 1.119 _refine_ls_hydrogen_treatment refxyz _refine_ls_matrix_type full _refine_ls_number_parameters 117 _refine_ls_number_reflns 2835 _refine_ls_number_restraints 0 _refine_ls_restrained_S_all 1.082 _refine_ls_restrained_S_obs 1.119 _refine_ls_R_factor_all .0534 _refine_ls_R_factor_gt .0348 _refine_ls_shift/esd_mean .001 _refine_ls_shift/su_max .040 _refine_ls_structure_factor_coef Fsqd _refine_ls_weighting_details 'calc w = 1/[\s^2^(Fo^2^)+(0.0425P)^2^] where P=(Fo^2^+2Fc^2^)/3' _refine_ls_weighting_scheme calc _refine_ls_wR_factor_all .0804 _refine_ls_wR_factor_ref .0735 _reflns_number_gt 2232 _reflns_number_total 2838 _reflns_threshold_expression >2sigma(I) _[local]_cod_data_source_file br1297.cif _[local]_cod_data_source_block I _[local]_cod_cif_authors_sg_H-M 'P 21/m' _cod_database_code 2011298 loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' '-x, y+1/2, -z' '-x, -y, -z' 'x, -y-1/2, z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv _atom_site_thermal_displace_type _atom_site_calc_flag _atom_site_refinement_flags _atom_site_occupancy _atom_site_disorder_group _atom_site_type_symbol Sr1 .38534(6) .44853(2) .29571(3) .01081(7) Uani d . 1 . Sr Sr2 .52609(10) .2500 .62463(5) .01287(9) Uani d S 1 . Sr Ga1 -.07776(11) .2500 .30908(5) .00971(10) Uani d S 1 . Ga Ga2 .16202(8) .37189(2) -.13029(4) .01025(8) Uani d . 1 . Ga B1 .0043(8) .3974(2) .5646(4) .0096(6) Uani d . 1 . B B2 -.2546(8) .3787(3) .0336(4) .0119(6) Uani d . 1 . B H -.515(16) .235(7) .225(9) .020 Uiso d P .50 . H O1 .1115(5) .3469(2) .4602(3) .0119(4) Uani d . 1 . O O2 .2001(5) .4363(2) .6957(3) .0142(4) Uani d . 1 . O O3 .4647(5) .3850(2) .0366(3) .0152(4) Uani d . 1 . O O4 -.4615(7) .2500 .3096(4) .0130(6) Uani d S 1 . O O5 -.1825(6) .4056(2) -.0994(3) .0195(5) Uani d . 1 . O O6 -.0533(5) .3488(2) .1587(3) .0153(4) Uani d . 1 . O O7 .1280(10) .2500 -.2127(4) .0219(8) Uani d S 1 . O O8 -.2757(5) .4077(2) .5506(3) .0128(4) Uani d . 1 . O loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_12 _atom_site_aniso_U_13 _atom_site_aniso_U_23 Sr1 .01031(13) .01163(12) .01008(12) -.00155(10) .00199(10) -.00006(9) Sr2 .0099(2) .0127(2) .0154(2) .000 .00224(15) .000 Ga1 .0080(2) .0110(2) .0098(2) .000 .0019(2) .000 Ga2 .0089(2) .01202(14) .00963(15) -.00001(12) .00206(12) .00019(11) B1 .0093(14) .0108(12) .0080(13) .0006(11) .0013(11) .0013(11) B2 .013(2) .0118(13) .0108(14) .0009(12) .0036(12) .0000(11) O1 .0107(11) .0127(9) .0131(10) .0011(8) .0048(8) -.0015(8) O2 .0140(11) .0182(10) .0102(10) -.0062(9) .0032(8) -.0006(8) O3 .0092(11) .0255(11) .0105(10) .0013(9) .0019(8) .0002(9) O4 .0074(15) .0177(14) .0131(15) .000 .0015(12) .000 O5 .0138(12) .0332(14) .0136(11) .0078(11) .0071(9) .0113(10) O6 .0110(11) .0202(10) .0132(10) -.0029(9) .0003(9) .0059(9) O7 .035(2) .0132(14) .017(2) .000 .007(2) .000 O8 .0082(10) .0174(10) .0125(10) .0024(8) .0020(8) .0010(8) loop_ _geom_bond_atom_site_label_1 _geom_bond_atom_site_label_2 _geom_bond_site_symmetry_2 _geom_bond_distance _geom_bond_publ_flag Sr1 O8 1_655 2.522(2) yes Sr1 O8 3_566 2.547(2) ? Sr1 O2 3_666 2.559(2) yes Sr1 O6 . 2.572(3) yes Sr1 O3 . 2.625(2) yes Sr1 O1 . 2.649(2) yes Sr1 O5 3_565 2.681(2) yes Sr1 O4 1_655 2.8118(10) yes Sr1 O2 3_566 3.296(3) ? Sr1 B1 3_566 3.314(3) ? Sr1 B1 1_655 3.422(3) ? Sr1 B2 1_655 3.448(4) ? Sr2 O8 1_655 2.529(2) yes Sr2 O8 4_665 2.529(2) ? Sr2 O1 4_565 2.550(2) ? Sr2 O1 . 2.550(2) yes Sr2 O7 1_556 2.741(4) yes Sr2 O4 1_655 2.868(4) yes Sr2 O7 1_656 2.930(5) yes Sr2 O2 4_565 3.165(3) ? Sr2 O2 . 3.165(3) ? Sr2 B1 4_565 3.191(3) ? Sr2 B1 . 3.191(3) ? Sr2 B1 1_655 3.248(3) ? Ga1 O4 . 1.885(4) yes Ga1 O6 4_565 1.944(2) ? Ga1 O6 . 1.944(2) yes Ga1 O1 . 1.953(2) yes Ga1 O1 4_565 1.953(2) ? Ga1 Sr1 4_565 3.5642(4) ? Ga1 Sr1 4_465 3.7637(5) ? Ga1 Sr1 1_455 3.7637(5) ? Ga1 Sr2 1_455 3.8580(7) ? Ga2 O7 . 1.816(2) yes Ga2 O3 . 1.824(2) yes Ga2 O5 . 1.844(3) yes Ga2 O2 1_554 1.856(2) yes Ga2 Sr2 1_554 3.6052(5) ? Ga2 Sr1 3_565 3.6546(5) ? Ga2 Sr2 1_454 3.7096(6) ? Ga2 Sr1 3_665 3.8703(5) ? B1 O8 . 1.354(4) yes B1 O1 . 1.383(4) yes B1 O2 . 1.417(4) yes B1 Sr2 1_455 3.248(3) ? B1 Sr1 3_566 3.314(3) ? B1 Sr1 1_455 3.422(3) ? B2 O6 . 1.353(4) yes B2 O3 1_455 1.388(4) yes B2 O5 . 1.391(4) yes B2 Sr1 1_455 3.448(4) ? O2 Ga2 1_556 1.856(2) ? O2 Sr1 3_666 2.559(2) ? O2 Sr1 3_566 3.296(3) ? O3 B2 1_655 1.388(4) ? O4 Sr1 4_465 2.8118(10) ? O4 Sr1 1_455 2.8118(10) ? O4 Sr2 1_455 2.868(4) ? O5 Sr1 3_565 2.681(2) ? O5 Sr2 1_454 3.303(3) ? O7 Ga2 4_565 1.816(2) ? O7 Sr2 1_554 2.741(4) ? O7 Sr2 1_454 2.930(5) ? O8 Sr1 1_455 2.522(2) ? O8 Sr2 1_455 2.529(2) ? O8 Sr1 3_566 2.547(2) ? loop_ _atom_type_symbol _atom_type_description _atom_type_scat_dispersion_real _atom_type_scat_dispersion_imag _atom_type_scat_source H H .0000 .0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' B B .0013 .0007 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' O O .0106 .0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' Ga Ga .2307 1.6083 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' Sr Sr -1.5307 3.2498 '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_site_symmetry_1 _geom_angle_site_symmetry_3 _geom_angle O8 Sr1 O8 1_655 3_566 81.68(8) O8 Sr1 O2 1_655 3_666 77.43(8) O8 Sr1 O2 3_566 3_666 77.87(8) O8 Sr1 O6 1_655 . 126.01(7) O8 Sr1 O6 3_566 . 113.65(8) O2 Sr1 O6 3_666 . 153.95(8) O8 Sr1 O3 1_655 . 121.68(8) O8 Sr1 O3 3_566 . 147.82(8) O2 Sr1 O3 3_666 . 85.73(8) O6 Sr1 O3 . . 72.40(8) O8 Sr1 O1 1_655 . 71.34(8) O8 Sr1 O1 3_566 . 83.45(7) O2 Sr1 O1 3_666 . 145.53(7) O6 Sr1 O1 . . 60.51(7) O3 Sr1 O1 . . 123.08(7) O8 Sr1 O5 1_655 3_565 144.01(8) O8 Sr1 O5 3_566 3_565 72.06(8) O2 Sr1 O5 3_666 3_565 73.39(8) O6 Sr1 O5 . 3_565 87.67(8) O3 Sr1 O5 . 3_565 76.82(8) O1 Sr1 O5 . 3_565 127.46(8) O8 Sr1 O4 1_655 1_655 69.02(9) O8 Sr1 O4 3_566 1_655 144.49(9) O2 Sr1 O4 3_666 1_655 113.11(9) O6 Sr1 O4 . 1_655 71.88(9) O3 Sr1 O4 . 1_655 67.58(9) O1 Sr1 O4 . 1_655 68.75(8) O5 Sr1 O4 3_565 1_655 142.77(10) O8 Sr1 O2 1_655 3_566 116.85(7) O8 Sr1 O2 3_566 3_566 46.05(7) O2 Sr1 O2 3_666 3_566 113.33(8) O6 Sr1 O2 . 3_566 68.99(7) O3 Sr1 O2 . 3_566 121.10(7) O1 Sr1 O2 . 3_566 70.25(6) O5 Sr1 O2 3_565 3_566 59.14(7) O4 Sr1 O2 1_655 3_566 133.25(8) O8 Sr1 B1 1_655 3_566 95.70(8) O8 Sr1 B1 3_566 3_566 22.13(8) O2 Sr1 B1 3_666 3_566 97.57(8) O6 Sr1 B1 . 3_566 91.55(9) O3 Sr1 B1 . 3_566 142.08(8) O1 Sr1 B1 . 3_566 71.89(7) O5 Sr1 B1 3_565 3_566 68.21(8) O4 Sr1 B1 1_655 3_566 140.52(9) O2 Sr1 B1 3_566 3_566 24.75(7) O8 Sr1 B1 1_655 1_655 19.81(8) O8 Sr1 B1 3_566 1_655 92.65(8) O2 Sr1 B1 3_666 1_655 63.62(8) O6 Sr1 B1 . 1_655 134.89(8) O3 Sr1 B1 . 1_655 104.65(8) O1 Sr1 B1 . 1_655 88.88(8) O5 Sr1 B1 3_565 1_655 136.59(8) O4 Sr1 B1 1_655 1_655 66.08(9) O2 Sr1 B1 3_566 1_655 134.09(7) B1 Sr1 B1 3_566 1_655 110.62(7) O8 Sr1 B2 1_655 1_655 103.51(8) O8 Sr1 B2 3_566 1_655 144.16(8) O2 Sr1 B2 3_666 1_655 69.05(8) O6 Sr1 B2 . 1_655 92.18(8) O3 Sr1 B2 . 1_655 21.41(8) O1 Sr1 B2 . 1_655 132.10(8) O5 Sr1 B2 3_565 1_655 85.32(8) O4 Sr1 B2 1_655 1_655 65.38(9) O2 Sr1 B2 3_566 1_655 139.29(7) B1 Sr1 B2 3_566 1_655 153.09(8) B1 Sr1 B2 1_655 1_655 84.95(9) O8 Sr2 O8 1_655 4_665 117.09(10) O8 Sr2 O1 1_655 4_565 126.33(7) O8 Sr2 O1 4_665 4_565 72.87(8) O8 Sr2 O1 1_655 . 72.87(8) O8 Sr2 O1 4_665 . 126.33(7) O1 Sr2 O1 4_565 . 62.64(10) O8 Sr2 O7 1_655 1_556 121.43(5) O8 Sr2 O7 4_665 1_556 121.43(5) O1 Sr2 O7 4_565 1_556 75.00(9) O1 Sr2 O7 . 1_556 75.00(9) O8 Sr2 O4 1_655 1_655 68.00(6) O8 Sr2 O4 4_665 1_655 68.00(6) O1 Sr2 O4 4_565 1_655 69.16(8) O1 Sr2 O4 . 1_655 69.16(8) O7 Sr2 O4 1_556 1_655 137.76(11) O8 Sr2 O7 1_655 1_656 74.06(6) O8 Sr2 O7 4_665 1_656 74.06(6) O1 Sr2 O7 4_565 1_656 146.60(6) O1 Sr2 O7 . 1_656 146.60(6) O7 Sr2 O7 1_556 1_656 119.86(13) O4 Sr2 O7 1_655 1_656 102.38(10) O8 Sr2 O2 1_655 4_565 172.58(7) O8 Sr2 O2 4_665 4_565 67.53(7) O1 Sr2 O2 4_565 4_565 48.07(7) O1 Sr2 O2 . 4_565 99.73(7) O7 Sr2 O2 1_556 4_565 54.53(4) O4 Sr2 O2 1_655 4_565 110.34(6) O7 Sr2 O2 1_656 4_565 113.26(6) O8 Sr2 O2 1_655 . 67.53(7) O8 Sr2 O2 4_665 . 172.58(7) O1 Sr2 O2 4_565 . 99.73(7) O1 Sr2 O2 . . 48.07(7) O7 Sr2 O2 1_556 . 54.53(4) O4 Sr2 O2 1_655 . 110.34(6) O7 Sr2 O2 1_656 . 113.26(6) O2 Sr2 O2 4_565 . 107.26(9) O8 Sr2 B1 1_655 4_565 147.34(8) O8 Sr2 B1 4_665 4_565 76.33(8) O1 Sr2 B1 4_565 4_565 24.81(8) O1 Sr2 B1 . 4_565 75.48(8) O7 Sr2 B1 1_556 4_565 55.73(8) O4 Sr2 B1 1_655 4_565 93.38(8) O7 Sr2 B1 1_656 4_565 137.92(7) O2 Sr2 B1 4_565 4_565 25.76(7) O2 Sr2 B1 . 4_565 96.72(8) O8 Sr2 B1 1_655 . 76.33(8) O8 Sr2 B1 4_665 . 147.34(8) O1 Sr2 B1 4_565 . 75.48(8) O1 Sr2 B1 . . 24.81(8) O7 Sr2 B1 1_556 . 55.73(8) O4 Sr2 B1 1_655 . 93.38(8) O7 Sr2 B1 1_656 . 137.92(7) O2 Sr2 B1 4_565 . 96.72(8) O2 Sr2 B1 . . 25.76(7) B1 Sr2 B1 4_565 . 78.39(12) O8 Sr2 B1 1_655 1_655 23.09(8) O8 Sr2 B1 4_665 1_655 98.01(8) O1 Sr2 B1 4_565 1_655 136.49(8) O1 Sr2 B1 . 1_655 94.58(8) O7 Sr2 B1 1_556 1_655 137.72(7) O4 Sr2 B1 1_655 1_655 68.07(8) O7 Sr2 B1 1_656 1_655 53.61(8) O2 Sr2 B1 4_565 1_655 163.92(8) O2 Sr2 B1 . 1_655 87.77(7) B1 Sr2 B1 4_565 1_655 161.26(12) B1 Sr2 B1 . 1_655 99.35(9) O4 Ga1 O6 . 4_565 104.43(11) O4 Ga1 O6 . . 104.43(11) O6 Ga1 O6 4_565 . 88.1(2) O4 Ga1 O1 . . 106.75(11) O6 Ga1 O1 4_565 . 148.81(11) O6 Ga1 O1 . . 84.93(10) O4 Ga1 O1 . 4_565 106.75(11) O6 Ga1 O1 4_565 4_565 84.93(10) O6 Ga1 O1 . 4_565 148.81(11) O1 Ga1 O1 . 4_565 85.49(14) O4 Ga1 Sr2 . . 128.57(11) O6 Ga1 Sr2 4_565 . 111.82(7) O6 Ga1 Sr2 . . 111.82(7) O1 Ga1 Sr2 . . 44.94(7) O1 Ga1 Sr2 4_565 . 44.94(7) O4 Ga1 Sr1 . . 130.305(9) O6 Ga1 Sr1 4_565 . 110.33(8) O6 Ga1 Sr1 . . 44.59(7) O1 Ga1 Sr1 . . 46.96(7) O1 Ga1 Sr1 4_565 . 110.60(7) Sr2 Ga1 Sr1 . . 67.737(10) O4 Ga1 Sr1 . 4_565 130.305(9) O6 Ga1 Sr1 4_565 4_565 44.59(7) O6 Ga1 Sr1 . 4_565 110.33(8) O1 Ga1 Sr1 . 4_565 110.60(7) O1 Ga1 Sr1 4_565 4_565 46.96(7) Sr2 Ga1 Sr1 . 4_565 67.737(10) Sr1 Ga1 Sr1 . 4_565 99.28(2) O4 Ga1 Sr1 . 4_465 46.245(9) O6 Ga1 Sr1 4_565 4_465 69.44(8) O6 Ga1 Sr1 . 4_465 130.71(8) O1 Ga1 Sr1 . 4_465 135.32(7) O1 Ga1 Sr1 4_565 4_465 74.43(7) Sr2 Ga1 Sr1 . 4_465 117.169(11) Sr1 Ga1 Sr1 . 4_465 174.97(2) Sr1 Ga1 Sr1 4_565 4_465 84.061(7) O4 Ga1 Sr1 . 1_455 46.245(9) O6 Ga1 Sr1 4_565 1_455 130.71(8) O6 Ga1 Sr1 . 1_455 69.44(8) O1 Ga1 Sr1 . 1_455 74.43(7) O1 Ga1 Sr1 4_565 1_455 135.32(7) Sr2 Ga1 Sr1 . 1_455 117.169(11) Sr1 Ga1 Sr1 . 1_455 84.061(7) Sr1 Ga1 Sr1 4_565 1_455 174.97(2) Sr1 Ga1 Sr1 4_465 1_455 92.369(14) O4 Ga1 Sr2 . 1_455 45.39(11) O6 Ga1 Sr2 4_565 1_455 130.92(8) O6 Ga1 Sr2 . 1_455 130.92(8) O1 Ga1 Sr2 . 1_455 73.83(7) O1 Ga1 Sr2 4_565 1_455 73.83(7) Sr2 Ga1 Sr2 . 1_455 83.182(14) Sr1 Ga1 Sr2 . 1_455 118.460(10) Sr1 Ga1 Sr2 4_565 1_455 118.460(10) Sr1 Ga1 Sr2 4_465 1_455 62.449(9) Sr1 Ga1 Sr2 1_455 1_455 62.449(9) O7 Ga2 O3 . . 113.31(15) O7 Ga2 O5 . . 107.7(2) O3 Ga2 O5 . . 115.35(11) O7 Ga2 O2 . 1_554 96.10(13) O3 Ga2 O2 . 1_554 114.34(11) O5 Ga2 O2 . 1_554 108.22(11) O7 Ga2 Sr2 . 1_554 47.87(13) O3 Ga2 Sr2 . 1_554 97.28(8) O5 Ga2 Sr2 . 1_554 146.42(9) O2 Ga2 Sr2 1_554 1_554 61.29(8) O7 Ga2 Sr1 . 3_565 118.15(13) O3 Ga2 Sr1 . 3_565 128.42(8) O5 Ga2 Sr1 . 3_565 44.77(7) O2 Ga2 Sr1 1_554 3_565 64.05(8) Sr2 Ga2 Sr1 1_554 3_565 119.316(12) O7 Ga2 Sr2 . 1_454 51.02(14) O3 Ga2 Sr2 . 1_454 155.48(8) O5 Ga2 Sr2 . 1_454 62.82(9) O2 Ga2 Sr2 1_554 1_454 87.97(8) Sr2 Ga2 Sr2 1_554 1_454 84.280(11) Sr1 Ga2 Sr2 3_565 1_454 69.337(9) O7 Ga2 Sr1 . . 129.04(11) O3 Ga2 Sr1 . . 36.33(8) O5 Ga2 Sr1 . . 79.01(8) O2 Ga2 Sr1 1_554 . 130.69(7) Sr2 Ga2 Sr1 1_554 . 133.150(13) Sr1 Ga2 Sr1 3_565 . 102.066(10) Sr2 Ga2 Sr1 1_454 . 133.569(13) O7 Ga2 Sr1 . 3_665 115.05(13) O3 Ga2 Sr1 . 3_665 80.37(8) O5 Ga2 Sr1 . 3_665 122.92(8) O2 Ga2 Sr1 1_554 3_665 34.24(8) Sr2 Ga2 Sr1 1_554 3_665 68.059(9) Sr1 Ga2 Sr1 3_565 3_665 81.375(9) Sr2 Ga2 Sr1 1_454 3_665 122.171(12) Sr1 Ga2 Sr1 . 3_665 100.011(10) O8 B1 O1 . . 123.3(3) O8 B1 O2 . . 119.0(3) O1 B1 O2 . . 117.6(3) O8 B1 Sr2 . . 146.2(2) O1 B1 Sr2 . . 50.69(15) O2 B1 Sr2 . . 76.1(2) O8 B1 Sr2 . 1_455 47.13(15) O1 B1 Sr2 . 1_455 103.2(2) O2 B1 Sr2 . 1_455 116.9(2) Sr2 B1 Sr2 . 1_455 99.35(9) O8 B1 Sr1 . 3_566 45.15(15) O1 B1 Sr1 . 3_566 160.3(2) O2 B1 Sr1 . 3_566 76.9(2) Sr2 B1 Sr1 . 3_566 148.82(11) Sr2 B1 Sr1 1_455 3_566 79.34(8) O8 B1 Sr1 . 1_455 39.15(14) O1 B1 Sr1 . 1_455 92.5(2) O2 B1 Sr1 . 1_455 142.6(2) Sr2 B1 Sr1 . 1_455 140.44(11) Sr2 B1 Sr1 1_455 1_455 72.62(7) Sr1 B1 Sr1 3_566 1_455 69.38(7) O6 B2 O3 . 1_455 120.7(3) O6 B2 O5 . . 120.4(3) O3 B2 O5 1_455 . 118.9(3) O6 B2 Sr1 . 1_455 84.4(2) O3 B2 Sr1 1_455 1_455 43.67(15) O5 B2 Sr1 . 1_455 144.8(2) B1 O1 Ga1 . . 128.4(2) B1 O1 Sr2 . . 104.5(2) Ga1 O1 Sr2 . . 102.30(9) B1 O1 Sr1 . . 117.6(2) Ga1 O1 Sr1 . . 100.43(9) Sr2 O1 Sr1 . . 98.94(8) B1 O2 Ga2 . 1_556 109.5(2) B1 O2 Sr1 . 3_666 127.8(2) Ga2 O2 Sr1 1_556 3_666 121.67(11) B1 O2 Sr2 . . 78.1(2) Ga2 O2 Sr2 1_556 . 87.74(9) Sr1 O2 Sr2 3_666 . 93.50(8) B1 O2 Sr1 . 3_566 78.3(2) Ga2 O2 Sr1 1_556 3_566 85.53(9) Sr1 O2 Sr1 3_666 3_566 113.33(8) Sr2 O2 Sr1 . 3_566 151.75(8) B2 O3 Ga2 1_655 . 124.9(2) B2 O3 Sr1 1_655 . 114.9(2) Ga2 O3 Sr1 . . 119.36(11) H O4 Ga1 . . 94(6) H O4 Sr1 . 4_465 71(7) Ga1 O4 Sr1 . 4_465 104.80(7) H O4 Sr1 . 1_455 102(7) Ga1 O4 Sr1 . 1_455 104.80(7) Sr1 O4 Sr1 4_465 1_455 149.97(14) H O4 Sr2 . 1_455 154(6) Ga1 O4 Sr2 . 1_455 106.71(15) Sr1 O4 Sr2 4_465 1_455 88.18(8) Sr1 O4 Sr2 1_455 1_455 88.18(8) B2 O5 Ga2 . . 121.3(2) B2 O5 Sr1 . 3_565 129.4(2) Ga2 O5 Sr1 . 3_565 106.26(10) B2 O5 Sr2 . 1_454 109.0(2) Ga2 O5 Sr2 . 1_454 87.40(9) Sr1 O5 Sr2 3_565 1_454 88.22(7) B2 O6 Ga1 . . 128.9(2) B2 O6 Sr1 . . 125.1(2) Ga1 O6 Sr1 . . 103.35(10) Ga2 O7 Ga2 . 4_565 133.3(2) Ga2 O7 Sr2 . 1_554 102.70(15) Ga2 O7 Sr2 4_565 1_554 102.70(15) Ga2 O7 Sr2 . 1_454 100.17(15) Ga2 O7 Sr2 4_565 1_454 100.17(15) Sr2 O7 Sr2 1_554 1_454 119.86(13) B1 O8 Sr1 . 1_455 121.0(2) B1 O8 Sr2 . 1_455 109.8(2) Sr1 O8 Sr2 1_455 1_455 102.95(8) B1 O8 Sr1 . 3_566 112.7(2) Sr1 O8 Sr1 1_455 3_566 98.32(8) Sr2 O8 Sr1 1_455 3_566 111.22(9) _cod_database_fobs_code 2011298 _journal_paper_doi 10.1107/S0108270100009021