data_CSAO11CE_publ _pd_block_id 2016-08-21T12:15|CSAO11CE|CSAO11Ce|XpertPro _audit_creation_method "from EXP file using GSAS2CIF" _audit_creation_date 2016-08-21T12:15 _audit_author_name CSAO11Ce _audit_update_record ; 2016-08-21T12:15 Initial CIF as created by GSAS2CIF ; #============================================================================= # this information describes the project, paper etc. for the CIF # # Acta Cryst. Section C papers and editorial correspondence is generated # # from the information in this section # # # # (from) CIF submission form for Rietveld refinements (Acta Cryst. C) # # Version 14 December 1998 # #============================================================================= # 1. SUBMISSION DETAILS _publ_contact_author_name ? # Name of author for correspondence _publ_contact_author_address # Address of author for correspondence ; ? ; _publ_contact_author_email ? _publ_contact_author_fax ? _publ_contact_author_phone ? _publ_contact_letter ; ? ; _publ_requested_journal ? _publ_requested_coeditor_name ? _publ_requested_category ? # Acta C: one of CI/CM/CO/FI/FM/FO #============================================================================== # 2. PROCESSING SUMMARY (IUCr Office Use Only) _journal_data_validation_number ? _journal_date_recd_electronic ? _journal_date_to_coeditor ? _journal_date_from_coeditor ? _journal_date_accepted ? _journal_date_printers_first ? _journal_date_printers_final ? _journal_date_proofs_out ? _journal_date_proofs_in ? _journal_coeditor_name ? _journal_coeditor_code ? _journal_coeditor_notes ; ? ; _journal_techeditor_code ? _journal_techeditor_notes ; ? ; _journal_coden_ASTM ? _journal_name_full ? _journal_year ? _journal_volume ? _journal_issue ? _journal_page_first ? _journal_page_last ? _journal_paper_category ? _journal_suppl_publ_number ? _journal_suppl_publ_pages ? #============================================================================== # 3. TITLE AND AUTHOR LIST _publ_section_title ; ? ; _publ_section_title_footnote ; ? ; # The loop structure below should contain the names and addresses of all # authors, in the required order of publication. Repeat as necessary. loop_ _publ_author_name _publ_author_footnote _publ_author_address ? #<--'Last name, first name' ; ? ; ; ? ; #============================================================================== # 4. TEXT _publ_section_synopsis ; ? ; _publ_section_abstract ; ? ; _publ_section_comment ; ? ; _publ_section_exptl_prep # Details of the preparation of the sample(s) # should be given here. ; ? ; _publ_section_exptl_refinement ; ? ; _publ_section_references ; ? ; _publ_section_figure_captions ; ? ; _publ_section_acknowledgements ; ? ; #============================================================================= # 5. OVERALL REFINEMENT & COMPUTING DETAILS _refine_special_details ; ? ; _pd_proc_ls_special_details ; ? ; # The following items are used to identify the programs used. _computing_molecular_graphics ? _computing_publication_material ? _refine_ls_weighting_scheme ? _refine_ls_weighting_details ? _refine_ls_hydrogen_treatment ? _refine_ls_extinction_method ? _refine_ls_extinction_coef ? _refine_ls_number_constraints ? _refine_ls_restrained_S_all ? _refine_ls_restrained_S_obs ? #============================================================================== # 6. SAMPLE PREPARATION DATA # (In the unusual case where multiple samples are used in a single # Rietveld study, this information should be moved into the phase # blocks) # The following three fields describe the preparation of the material. # The cooling rate is in K/min. The pressure at which the sample was # prepared is in kPa. The temperature of preparation is in K. _pd_prep_cool_rate ? _pd_prep_pressure ? _pd_prep_temperature ? _pd_char_colour ? # use ICDD colour descriptions _refine_ls_shift/su_max 4.10 _refine_ls_shift/su_mean 0.26 _computing_structure_refinement GSAS _refine_ls_number_parameters 16 _refine_ls_goodness_of_fit_all 1.56 _refine_ls_number_restraints 0 _refine_ls_matrix_type full #============================================================================== # 7. CHEMICAL, STRUCTURAL AND CRYSTAL DATA _pd_char_particle_morphology ? _chemical_name_systematic ; ? ; _chemical_name_common ? _chemical_formula_moiety ? _chemical_formula_structural ? _chemical_formula_analytical ? _chemical_melting_point ? _chemical_compound_source ? # for minerals and # natural products _symmetry_space_group_name_Hall ? _exptl_crystal_F_000 ? _exptl_crystal_density_diffrn ? _exptl_crystal_density_meas ? _exptl_crystal_density_method ? _cell_measurement_temperature ? _cell_special_details ; ? ; _geom_special_details ? # The following item identifies the program(s) used (if appropriate). _computing_structure_solution ? #============================================================================== # 8. Phase information from GSAS _pd_phase_name "from D:/GSAS/CSAO/rawdata/Ca3Al2O6.cif" _cell_length_a 15.3478(4) _cell_length_b 15.3478 _cell_length_c 15.3478 _cell_angle_alpha 90.0 _cell_angle_beta 90.0 _cell_angle_gamma 90.0 _cell_volume 3615.26(30) _symmetry_cell_setting cubic _symmetry_space_group_name_H-M "P a -3" loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 +x,+y,+z 2 +z,+x,+y 3 +y,+z,+x 4 +x+1/2,+y,-z+1/2 5 -z+1/2,+x+1/2,+y 6 +y,-z+1/2,+x+1/2 7 -z,+x+1/2,-y+1/2 8 -y+1/2,-z,+x+1/2 9 +y+1/2,-z+1/2,-x 10 -x,+y+1/2,-z+1/2 11 -z+1/2,-x,+y+1/2 12 +x+1/2,-y+1/2,-z -1 -x,-y,-z -2 -z,-x,-y -3 -y,-z,-x -4 -x+1/2,-y,+z+1/2 -5 +z+1/2,-x+1/2,-y -6 -y,+z+1/2,-x+1/2 -7 +z,-x+1/2,+y+1/2 -8 +y+1/2,+z,-x+1/2 -9 -y+1/2,+z+1/2,+x -10 +x,-y+1/2,+z+1/2 -11 +z+1/2,+x,-y+1/2 -12 -x+1/2,+y+1/2,+z # ATOMIC COORDINATES AND DISPLACEMENT PARAMETERS loop_ _atom_site_type_symbol _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy _atom_site_thermal_displace_type _atom_site_U_iso_or_equiv _atom_site_symmetry_multiplicity Ca Ca1 0.0 0.0 0.0 0.8386 Uiso 0.032 4 Ca Ca2 0.5 0.0 0.0 0.8386 Uiso 0.00906 4 Ca Ca3 0.25906 0.25906 0.25906 0.8314 Uiso 0.0316 8 Ca Ca4 0.37937 0.37937 0.37937 0.09907 Uiso 0.0043 8 Ca Ca5 0.13807 0.37097 0.13619 0.69031 Uiso 0.032 24 Ca Ca6 0.38246 0.38141 0.1219 1.0 Uiso 0.00453 24 Al Al1 0.24505 0.00839 0.00966 1.0 Uiso 0.01355 24 Al Al2 0.23134 0.24858 0.01073 1.0 Uiso 0.01615 24 O- O1 0.25032 0.14292 0.00184 1.0 Uiso 0.01033 24 O- O2 0.47745 0.12056 0.25239 1.0 Uiso 0.01669 24 O- O3 0.2701 0.29425 0.11405 1.0 Uiso 0.01165 24 O- O4 0.22701 0.41082 0.29829 1.0 Uiso 0.01669 24 O- O5 0.33349 -0.01905 -0.02749 1.0 Uiso 0.01165 24 O- O6 0.14436 -0.00176 -0.02084 1.0 Uiso 0.00202 24 Li Li1 0.0 0.0 0.0 0.1614 Uiso 0.032 4 Li Li2 0.5 0.0 0.0 0.1614 Uiso 0.00906 4 Li Li3 0.25906 0.25906 0.25906 0.1686 Uiso 0.0316 8 Sr Sr4 0.37937 0.37937 0.37937 0.81911 Uiso 0.0043 8 Ce Ce4 0.37937 0.37937 0.37937 0.08182 Uiso 0.0043 8 Sr Sr5 0.13807 0.37097 0.13619 0.22696 Uiso 0.032 24 Ce Ce5 0.13807 0.37097 0.13619 0.08273 Uiso 0.032 24 # If you change Z, be sure to change all 3 of the following _chemical_formula_sum "Al2 Ca2.28 Ce0.11 Li0.11 O6 Sr0.50" _chemical_formula_weight 301.33 _cell_formula_units_Z 24 # MOLECULAR GEOMETRY loop_ _geom_bond_atom_site_label_1 _geom_bond_atom_site_label_2 _geom_bond_distance _geom_bond_site_symmetry_1 _geom_bond_site_symmetry_2 _geom_bond_publ_flag Ca1 Ca6 3.17288(7) . 7_545 N Ca1 Ca6 3.17288(7) . 8_554 N Ca1 Ca6 3.17288(7) . 12_455 N Ca1 Ca6 3.17288(7) . -7_554 N Ca1 Ca6 3.17288(7) . -8_455 N Ca1 Ca6 3.17288(7) . -12_545 N Ca1 Al1 3.76611(10) . 1_555 N Ca1 Al1 3.76611(10) . 2_555 N Ca1 Al1 3.76611(10) . 3_555 N Ca1 Al1 3.76611(10) . -1_555 N Ca1 Al1 3.76611(10) . -2_555 N Ca1 Al1 3.76611(10) . -3_555 N Ca1 O6 2.23878(6) . 1_555 N Ca1 O6 2.23878(6) . 2_555 N Ca1 O6 2.23878(6) . 3_555 N Ca1 O6 2.23878(6) . -1_555 N Ca1 O6 2.23878(6) . -2_555 N Ca1 O6 2.23878(6) . -3_555 N Ca2 Ca4 3.20684(7) . 6_554 N Ca2 Ca4 3.20684(7) . 7_645 N Ca2 Ca5 3.57510(7) . 3_555 N Ca2 Ca5 3.57510(8) . 11_554 N Ca2 Ca5 3.57510(7) . 12_555 N Ca2 Ca5 3.57510(7) . -3_655 N Ca2 Ca5 3.57510(8) . -11_555 N Ca2 Ca5 3.57510(7) . -12_545 N Ca2 O5 2.60667(7) . 1_555 N Ca2 O5 2.60667(7) . 5_545 N Ca2 O5 2.60667(7) . 8_554 N Ca2 O5 2.60667(7) . -1_655 N Ca2 O5 2.60667(7) . -5_555 N Ca2 O5 2.60667(7) . -8_555 N Ca2 Sr4 3.20684(7) . 6_554 N Ca2 Sr4 3.20684(7) . 7_645 N Ca2 Ce4 3.20684(7) . 6_554 N Ca2 Ce4 3.20684(7) . 7_645 N Ca2 Sr5 3.57510(7) . 3_555 N Ca2 Sr5 3.57510(8) . 11_554 N Ca2 Sr5 3.57510(7) . 12_555 N Ca2 Sr5 3.57510(7) . -3_655 N Ca2 Sr5 3.57510(8) . -11_555 N Ca2 Sr5 3.57510(7) . -12_545 N Ca2 Ce5 3.57510(7) . 3_555 N Ca2 Ce5 3.57510(8) . 11_554 N Ca2 Ce5 3.57510(7) . 12_555 N Ca2 Ce5 3.57510(7) . -3_655 N Ca2 Ce5 3.57510(8) . -11_555 N Ca2 Ce5 3.57510(7) . -12_545 N Ca3 Ca4 3.19814(7) . 1_555 N Ca3 Ca5 3.15503(6) . 1_555 N Ca3 Ca5 3.15503(7) . 2_555 N Ca3 Ca5 3.15503(6) . 3_555 N Ca3 Ca6 3.39776(7) . 1_555 N Ca3 Ca6 3.39776(7) . 2_555 N Ca3 Ca6 3.39776(7) . 3_555 N Ca3 O3 2.29645(6) . 1_555 N Ca3 O3 2.29645(6) . 2_555 N Ca3 O3 2.29645(6) . 3_555 N Ca3 O4 2.45557(6) . 1_555 N Ca3 O4 2.45557(6) . 2_555 N Ca3 O4 2.45557(7) . 3_555 N Ca3 Sr4 3.19814(7) . 1_555 N Ca3 Ce4 3.19814(7) . 1_555 N Ca3 Sr5 3.15503(6) . 1_555 N Ca3 Sr5 3.15503(7) . 2_555 N Ca3 Sr5 3.15503(6) . 3_555 N Ca3 Ce5 3.15503(6) . 1_555 N Ca3 Ce5 3.15503(7) . 2_555 N Ca3 Ce5 3.15503(6) . 3_555 N Ca4 Ca2 3.20684(7) . 9_556 N Ca4 Ca3 3.19814(7) . 1_555 N Ca4 Ca5 3.97974(11) . 4_555 N Ca4 Ca5 3.97974(11) . 5_555 N Ca4 Ca5 3.97974(11) . 6_555 N Ca4 Ca6 3.95200(11) . 1_555 N Ca4 Ca6 3.95200(11) . 2_555 N Ca4 Ca6 3.95200(11) . 3_555 N Ca4 Al1 3.34907(7) . -9_555 N Ca4 Al1 3.34907(7) . -10_555 N Ca4 Al1 3.34907(7) . -11_555 N Ca4 Al2 3.61695(7) . -9_555 N Ca4 Al2 3.61695(8) . -10_555 N Ca4 Al2 3.61695(8) . -11_555 N Ca4 O1 2.75194(5) . -9_555 N Ca4 O1 2.75194(5) . -10_555 N Ca4 O1 2.75194(8) . -11_555 N Ca4 O4 2.69241(6) . 1_555 N Ca4 O4 2.69241(7) . 2_555 N Ca4 O4 2.69241(6) . 3_555 N Ca4 O5 2.67120(7) . -9_555 N Ca4 O5 2.67120(6) . -10_555 N Ca4 O5 2.67120(5) . -11_555 N Ca4 Li2 3.20684(7) . 9_556 N Ca4 Li3 3.19814(7) . 1_555 N Ca4 Sr5 3.97974(11) . 4_555 N Ca4 Sr5 3.97974(11) . 5_555 N Ca4 Sr5 3.97974(11) . 6_555 N Ca4 Ce5 3.97974(11) . 4_555 N Ca4 Ce5 3.97974(11) . 5_555 N Ca4 Ce5 3.97974(11) . 6_555 N Ca5 Ca2 3.57510(7) . 2_555 N Ca5 Ca3 3.15503(6) . 1_555 N Ca5 Ca4 3.97974(11) . 4_455 N Ca5 Ca5 4.07312(11) . -7_554 N Ca5 Ca5 4.07312(11) . -9_555 N Ca5 Ca6 3.76070(10) . 1_555 N Ca5 Ca6 3.77587(10) . 2_555 N Ca5 Al1 3.38612(7) . 2_555 N Ca5 Al1 3.59249(8) . -6_555 N Ca5 Al1 3.38201(7) . -12_555 N Ca5 Al2 3.04724(6) . 1_555 N Ca5 Al2 3.37450(7) . 2_555 N Ca5 Al2 3.12412(7) . -9_555 N Ca5 O1 2.79477(8) . 2_555 N Ca5 O2 2.40978(7) . 2_555 N Ca5 O2 3.09714(6) . 6_554 N Ca5 O3 2.36819(6) . 1_555 N Ca5 O3 2.90117(6) . 2_555 N Ca5 O4 2.90296(6) . 1_555 N Ca5 O5 2.44581(7) . -6_555 N Ca5 O5 3.05800(6) . -12_555 N Ca5 Li2 3.57510(7) . 2_555 N Ca5 Li3 3.15503(6) . 1_555 N Ca5 Sr4 3.97974(11) . 4_455 N Ca5 Ce4 3.97974(11) . 4_455 N Ca5 Sr5 4.07312(11) . -7_554 N Ca5 Sr5 4.07312(11) . -9_555 N Ca5 Ce5 4.07312(11) . -7_554 N Ca5 Ce5 4.07312(11) . -9_555 N Ca6 Ca1 3.17288(7) . 5_555 N Ca6 Ca3 3.39776(7) . 1_555 N Ca6 Ca4 3.95200(11) . 1_555 N Ca6 Ca5 3.76070(10) . 1_555 N Ca6 Ca5 3.77587(10) . 3_555 N Ca6 Ca6 3.67527(10) . 6_554 N Ca6 Ca6 3.67527(10) . -11_555 N Ca6 Al1 3.40256(7) . -5_555 N Ca6 Al1 3.20209(7) . -9_555 N Ca6 Al1 3.25497(7) . -12_555 N Ca6 Al2 3.52804(8) . 1_555 N Ca6 Al2 3.28705(7) . -9_555 N Ca6 Al2 3.62394(8) . -11_555 N Ca6 O1 2.72995(5) . -9_555 N Ca6 O2 2.48156(7) . 2_555 N Ca6 O3 2.18590(6) . 1_555 N Ca6 O4 2.10228(4) . 3_555 N Ca6 O6 2.39981(5) . -5_555 N Ca6 O6 2.39206(7) . -9_555 N Ca6 O6 2.86075(6) . -12_555 N Ca6 Li1 3.17288(7) . 5_555 N Ca6 Li3 3.39776(7) . 1_555 N Ca6 Sr4 3.95200(11) . 1_555 N Ca6 Ce4 3.95200(11) . 1_555 N Ca6 Sr5 3.76070(10) . 1_555 N Ca6 Sr5 3.77587(10) . 3_555 N Ca6 Ce5 3.76070(10) . 1_555 N Ca6 Ce5 3.77587(10) . 3_555 N Al1 Ca1 3.76611(10) . 1_555 N Al1 Ca4 3.34907(7) . 6_554 N Al1 Ca5 3.38612(7) . 3_555 N Al1 Ca5 3.59249(7) . 11_554 N Al1 Ca5 3.38201(7) . -12_545 N Al1 Ca6 3.40256(7) . 8_554 N Al1 Ca6 3.20209(6) . -7_554 N Al1 Ca6 3.25497(7) . -12_545 N Al1 O1 2.06976(6) . 1_555 N Al1 O2 1.76754(5) . 5_545 N Al1 O5 1.53128(4) . 1_555 N Al1 O6 1.62220(4) . 1_555 N Al1 Sr4 3.34907(7) . 6_554 N Al1 Ce4 3.34907(7) . 6_554 N Al1 Sr5 3.38612(7) . 3_555 N Al1 Sr5 3.59249(7) . 11_554 N Al1 Sr5 3.38201(7) . -12_545 N Al1 Ce5 3.38612(7) . 3_555 N Al1 Ce5 3.59249(7) . 11_554 N Al1 Ce5 3.38201(7) . -12_545 N Al2 Ca4 3.61695(8) . 6_554 N Al2 Ca5 3.04724(6) . 1_555 N Al2 Ca5 3.37450(7) . 3_555 N Al2 Ca5 3.12412(6) . -7_554 N Al2 Ca6 3.52804(8) . 1_555 N Al2 Ca6 3.62394(8) . 6_554 N Al2 Ca6 3.28705(7) . -7_554 N Al2 O1 1.65323(5) . 1_555 N Al2 O2 1.77521(5) . 6_554 N Al2 O3 1.83295(4) . 1_555 N Al2 O4 1.88348(4) . -7_554 N Al2 Sr4 3.61695(8) . 6_554 N Al2 Ce4 3.61695(8) . 6_554 N Al2 Sr5 3.04724(6) . 1_555 N Al2 Sr5 3.37450(7) . 3_555 N Al2 Sr5 3.12412(6) . -7_554 N Al2 Ce5 3.04724(6) . 1_555 N Al2 Ce5 3.37450(7) . 3_555 N Al2 Ce5 3.12412(6) . -7_554 N O1 Ca4 2.75194(5) . 6_554 N O1 Ca5 2.79477(6) . 3_555 N O1 Ca6 2.72995(5) . -7_554 N O1 Al1 2.06976(6) . 1_555 N O1 Al2 1.65323(5) . 1_555 N O1 Sr4 2.75194(5) . 6_554 N O1 Ce4 2.75194(5) . 6_554 N O1 Sr5 2.79477(6) . 3_555 N O1 Ce5 2.79477(6) . 3_555 N O2 Ca5 2.40978(5) . 3_555 N O2 Ca5 3.09714(6) . -11_555 N O2 Ca6 2.48156(5) . 3_555 N O2 Al1 1.76754(5) . -8_555 N O2 Al2 1.77521(5) . -11_555 N O2 Sr5 2.40978(5) . 3_555 N O2 Sr5 3.09714(6) . -11_555 N O2 Ce5 2.40978(5) . 3_555 N O2 Ce5 3.09714(6) . -11_555 N O3 Ca3 2.29645(6) . 1_555 N O3 Ca5 2.36819(6) . 1_555 N O3 Ca5 2.90117(8) . 3_555 N O3 Ca6 2.18590(6) . 1_555 N O3 Al2 1.83295(4) . 1_555 N O3 Li3 2.29645(6) . 1_555 N O3 Sr5 2.36819(6) . 1_555 N O3 Sr5 2.90117(8) . 3_555 N O3 Ce5 2.36819(6) . 1_555 N O3 Ce5 2.90117(8) . 3_555 N O4 Ca3 2.45557(6) . 1_555 N O4 Ca4 2.69241(6) . 1_555 N O4 Ca5 2.90296(6) . 1_555 N O4 Ca6 2.10228(4) . 2_555 N O4 Al2 1.88348(4) . -9_555 N O4 Li3 2.45557(6) . 1_555 N O4 Sr4 2.69241(6) . 1_555 N O4 Ce4 2.69241(6) . 1_555 N O4 Sr5 2.90296(6) . 1_555 N O4 Ce5 2.90296(6) . 1_555 N O5 Ca2 2.60667(7) . 1_555 N O5 Ca4 2.67120(6) . 6_554 N O5 Ca5 2.44581(5) . 11_554 N O5 Ca5 3.05799(6) . -12_545 N O5 Al1 1.53128(4) . 1_555 N O5 Li2 2.60667(7) . 1_555 N O5 Sr4 2.67120(6) . 6_554 N O5 Ce4 2.67120(6) . 6_554 N O5 Sr5 2.44581(5) . 11_554 N O5 Sr5 3.05799(6) . -12_545 N O5 Ce5 2.44581(5) . 11_554 N O5 Ce5 3.05799(6) . -12_545 N O6 Ca1 2.23878(6) . 1_555 N O6 Ca6 2.39981(5) . 8_554 N O6 Ca6 2.39206(5) . -7_554 N O6 Ca6 2.86075(6) . -12_545 N O6 Al1 1.62220(4) . 1_555 N O6 Li1 2.23878(6) . 1_555 N Li1 Ca6 3.17288(7) . 7_545 N Li1 Ca6 3.17288(7) . 8_554 N Li1 Ca6 3.17288(7) . 12_455 N Li1 Ca6 3.17288(7) . -7_554 N Li1 Ca6 3.17288(7) . -8_455 N Li1 Ca6 3.17288(7) . -12_545 N Li1 O6 2.23878(6) . 1_555 N Li1 O6 2.23878(6) . 2_555 N Li1 O6 2.23878(6) . 3_555 N Li1 O6 2.23878(6) . -1_555 N Li1 O6 2.23878(6) . -2_555 N Li1 O6 2.23878(6) . -3_555 N Li2 Ca4 3.20684(7) . 6_554 N Li2 Ca4 3.20684(7) . 7_645 N Li2 Ca5 3.57510(7) . 3_555 N Li2 Ca5 3.57510(8) . 11_554 N Li2 Ca5 3.57510(7) . 12_555 N Li2 Ca5 3.57510(7) . -3_655 N Li2 Ca5 3.57510(8) . -11_555 N Li2 Ca5 3.57510(7) . -12_545 N Li2 O5 2.60667(7) . 1_555 N Li2 O5 2.60667(7) . 5_545 N Li2 O5 2.60667(7) . 8_554 N Li2 O5 2.60667(7) . -1_655 N Li2 O5 2.60667(7) . -5_555 N Li2 O5 2.60667(7) . -8_555 N Li2 Sr4 3.20684(7) . 6_554 N Li2 Sr4 3.20684(7) . 7_645 N Li2 Ce4 3.20684(7) . 6_554 N Li2 Ce4 3.20684(7) . 7_645 N Li2 Sr5 3.57510(7) . 3_555 N Li2 Sr5 3.57510(8) . 11_554 N Li2 Sr5 3.57510(7) . 12_555 N Li2 Sr5 3.57510(7) . -3_655 N Li2 Sr5 3.57510(8) . -11_555 N Li2 Sr5 3.57510(7) . -12_545 N Li2 Ce5 3.57510(7) . 3_555 N Li2 Ce5 3.57510(8) . 11_554 N Li2 Ce5 3.57510(7) . 12_555 N Li2 Ce5 3.57510(7) . -3_655 N Li2 Ce5 3.57510(8) . -11_555 N Li2 Ce5 3.57510(7) . -12_545 N Li3 Ca4 3.19814(7) . 1_555 N Li3 Ca5 3.15503(6) . 1_555 N Li3 Ca5 3.15503(7) . 2_555 N Li3 Ca5 3.15503(6) . 3_555 N Li3 Ca6 3.39776(7) . 1_555 N Li3 Ca6 3.39776(7) . 2_555 N Li3 Ca6 3.39776(7) . 3_555 N Li3 O3 2.29645(6) . 1_555 N Li3 O3 2.29645(6) . 2_555 N Li3 O3 2.29645(6) . 3_555 N Li3 O4 2.45557(6) . 1_555 N Li3 O4 2.45557(6) . 2_555 N Li3 O4 2.45557(7) . 3_555 N Li3 Sr4 3.19814(7) . 1_555 N Li3 Ce4 3.19814(7) . 1_555 N Li3 Sr5 3.15503(6) . 1_555 N Li3 Sr5 3.15503(7) . 2_555 N Li3 Sr5 3.15503(6) . 3_555 N Li3 Ce5 3.15503(6) . 1_555 N Li3 Ce5 3.15503(7) . 2_555 N Li3 Ce5 3.15503(6) . 3_555 N Sr4 Ca2 3.20684(7) . 9_556 N Sr4 Ca3 3.19814(7) . 1_555 N Sr4 Ca5 3.97974(11) . 4_555 N Sr4 Ca5 3.97974(11) . 5_555 N Sr4 Ca5 3.97974(11) . 6_555 N Sr4 Ca6 3.95200(11) . 1_555 N Sr4 Ca6 3.95200(11) . 2_555 N Sr4 Ca6 3.95200(11) . 3_555 N Sr4 Al1 3.34907(7) . -9_555 N Sr4 Al1 3.34907(7) . -10_555 N Sr4 Al1 3.34907(7) . -11_555 N Sr4 Al2 3.61695(7) . -9_555 N Sr4 Al2 3.61695(8) . -10_555 N Sr4 Al2 3.61695(8) . -11_555 N Sr4 O1 2.75194(5) . -9_555 N Sr4 O1 2.75194(5) . -10_555 N Sr4 O1 2.75194(8) . -11_555 N Sr4 O4 2.69241(6) . 1_555 N Sr4 O4 2.69241(7) . 2_555 N Sr4 O4 2.69241(6) . 3_555 N Sr4 O5 2.67120(7) . -9_555 N Sr4 O5 2.67120(6) . -10_555 N Sr4 O5 2.67120(5) . -11_555 N Sr4 Li2 3.20684(7) . 9_556 N Sr4 Li3 3.19814(7) . 1_555 N Sr4 Sr5 3.97974(11) . 4_555 N Sr4 Sr5 3.97974(11) . 5_555 N Sr4 Sr5 3.97974(11) . 6_555 N Sr4 Ce5 3.97974(11) . 4_555 N Sr4 Ce5 3.97974(11) . 5_555 N Sr4 Ce5 3.97974(11) . 6_555 N Ce4 Ca2 3.20684(7) . 9_556 N Ce4 Ca3 3.19814(7) . 1_555 N Ce4 Ca5 3.97974(11) . 4_555 N Ce4 Ca5 3.97974(11) . 5_555 N Ce4 Ca5 3.97974(11) . 6_555 N Ce4 Ca6 3.95200(11) . 1_555 N Ce4 Ca6 3.95200(11) . 2_555 N Ce4 Ca6 3.95200(11) . 3_555 N Ce4 Al1 3.34907(7) . -9_555 N Ce4 Al1 3.34907(7) . -10_555 N Ce4 Al1 3.34907(7) . -11_555 N Ce4 Al2 3.61695(7) . -9_555 N Ce4 Al2 3.61695(8) . -10_555 N Ce4 Al2 3.61695(8) . -11_555 N Ce4 O1 2.75194(5) . -9_555 N Ce4 O1 2.75194(5) . -10_555 N Ce4 O1 2.75194(8) . -11_555 N Ce4 O4 2.69241(6) . 1_555 N Ce4 O4 2.69241(7) . 2_555 N Ce4 O4 2.69241(6) . 3_555 N Ce4 O5 2.67120(7) . -9_555 N Ce4 O5 2.67120(6) . -10_555 N Ce4 O5 2.67120(5) . -11_555 N Ce4 Li2 3.20684(7) . 9_556 N Ce4 Li3 3.19814(7) . 1_555 N Ce4 Sr5 3.97974(11) . 4_555 N Ce4 Sr5 3.97974(11) . 5_555 N Ce4 Sr5 3.97974(11) . 6_555 N Ce4 Ce5 3.97974(11) . 4_555 N Ce4 Ce5 3.97974(11) . 5_555 N Ce4 Ce5 3.97974(11) . 6_555 N Sr5 Ca2 3.57510(7) . 2_555 N Sr5 Ca3 3.15503(6) . 1_555 N Sr5 Ca4 3.97974(11) . 4_455 N Sr5 Ca5 4.07312(11) . -7_554 N Sr5 Ca5 4.07312(11) . -9_555 N Sr5 Ca6 3.76070(10) . 1_555 N Sr5 Ca6 3.77587(10) . 2_555 N Sr5 Al1 3.38612(7) . 2_555 N Sr5 Al1 3.59249(8) . -6_555 N Sr5 Al1 3.38201(7) . -12_555 N Sr5 Al2 3.04724(6) . 1_555 N Sr5 Al2 3.37450(7) . 2_555 N Sr5 Al2 3.12412(7) . -9_555 N Sr5 O1 2.79477(8) . 2_555 N Sr5 O2 2.40978(7) . 2_555 N Sr5 O2 3.09714(6) . 6_554 N Sr5 O3 2.36819(6) . 1_555 N Sr5 O3 2.90117(6) . 2_555 N Sr5 O4 2.90296(6) . 1_555 N Sr5 O5 2.44581(7) . -6_555 N Sr5 O5 3.05800(6) . -12_555 N Sr5 Li2 3.57510(7) . 2_555 N Sr5 Li3 3.15503(6) . 1_555 N Sr5 Sr4 3.97974(11) . 4_455 N Sr5 Ce4 3.97974(11) . 4_455 N Sr5 Sr5 4.07312(11) . -7_554 N Sr5 Sr5 4.07312(11) . -9_555 N Sr5 Ce5 4.07312(11) . -7_554 N Sr5 Ce5 4.07312(11) . -9_555 N Ce5 Ca2 3.57510(7) . 2_555 N Ce5 Ca3 3.15503(6) . 1_555 N Ce5 Ca4 3.97974(11) . 4_455 N Ce5 Ca5 4.07312(11) . -7_554 N Ce5 Ca5 4.07312(11) . -9_555 N Ce5 Ca6 3.76070(10) . 1_555 N Ce5 Ca6 3.77587(10) . 2_555 N Ce5 Al1 3.38612(7) . 2_555 N Ce5 Al1 3.59249(8) . -6_555 N Ce5 Al1 3.38201(7) . -12_555 N Ce5 Al2 3.04724(6) . 1_555 N Ce5 Al2 3.37450(7) . 2_555 N Ce5 Al2 3.12412(7) . -9_555 N Ce5 O1 2.79477(8) . 2_555 N Ce5 O2 2.40978(7) . 2_555 N Ce5 O2 3.09714(6) . 6_554 N Ce5 O3 2.36819(6) . 1_555 N Ce5 O3 2.90117(6) . 2_555 N Ce5 O4 2.90296(6) . 1_555 N Ce5 O5 2.44581(7) . -6_555 N Ce5 O5 3.05800(6) . -12_555 N Ce5 Li2 3.57510(7) . 2_555 N Ce5 Li3 3.15503(6) . 1_555 N Ce5 Sr4 3.97974(11) . 4_455 N Ce5 Ce4 3.97974(11) . 4_455 N Ce5 Sr5 4.07312(11) . -7_554 N Ce5 Sr5 4.07312(11) . -9_555 N 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_2 _geom_angle_site_symmetry_3 _geom_angle_publ_flag Ca6 Ca1 Ca6 109.2159(10) 7_545 . 8_554 N Ca6 Ca1 Ca6 109.2159(11) 7_545 . 12_455 N Ca6 Ca1 Ca6 180.0 7_545 . -7_455 N Ca6 Ca1 Ca6 70.7841(10) 7_545 . -8_446 N Ca6 Ca1 Ca6 70.7841(11) 7_545 . -12_545 N Ca6 Ca1 O6 131.19749(20) 7_545 . 1_555 N Ca6 Ca1 O6 119.0362(4) 7_545 . 2_555 N Ca6 Ca1 O6 49.0014(8) 7_545 . 3_555 N Ca6 Ca1 O6 48.80250(20) 7_545 . -1_555 N Ca6 Ca1 O6 60.9638(4) 7_545 . -2_555 N Ca6 Ca1 O6 130.9986(8) 7_545 . -3_555 N Ca6 Ca1 Ca6 109.2159(21) 8_554 . 12_455 N Ca6 Ca1 Ca6 70.7841(10) 8_554 . -7_455 N Ca6 Ca1 Ca6 180.0 8_554 . -8_446 N Ca6 Ca1 Ca6 70.7841(21) 8_554 . -12_545 N Ca6 Ca1 O6 49.00140(20) 8_554 . 1_555 N Ca6 Ca1 O6 131.1975(7) 8_554 . 2_555 N Ca6 Ca1 O6 119.0362(13) 8_554 . 3_555 N Ca6 Ca1 O6 130.99860(20) 8_554 . -1_555 N Ca6 Ca1 O6 48.8025(7) 8_554 . -2_555 N Ca6 Ca1 O6 60.9638(13) 8_554 . -3_555 N Ca6 Ca1 Ca6 70.7841(11) 12_455 . -7_455 N Ca6 Ca1 Ca6 70.7841(21) 12_455 . -8_446 N Ca6 Ca1 Ca6 180.0 12_455 . -12_545 N Ca6 Ca1 O6 119.0362(9) 12_455 . 1_555 N Ca6 Ca1 O6 49.0014(6) 12_455 . 2_555 N Ca6 Ca1 O6 131.1975(9) 12_455 . 3_555 N Ca6 Ca1 O6 60.9638(9) 12_455 . -1_555 N Ca6 Ca1 O6 130.9986(6) 12_455 . -2_555 N Ca6 Ca1 O6 48.8025(9) 12_455 . -3_555 N Ca6 Ca1 Ca6 109.2159(10) -7_455 . -8_446 N Ca6 Ca1 Ca6 109.2159(11) -7_455 . -12_545 N Ca6 Ca1 O6 48.80250(20) -7_565 . 1_555 N Ca6 Ca1 O6 60.9638(4) -7_565 . 2_555 N Ca6 Ca1 O6 130.9986(8) -7_565 . 3_555 N Ca6 Ca1 O6 131.19749(20) -7_565 . -1_555 N Ca6 Ca1 O6 119.0362(4) -7_565 . -2_555 N Ca6 Ca1 O6 49.0014(8) -7_565 . -3_555 N Ca6 Ca1 Ca6 109.2159(21) -8_446 . -12_545 N Ca6 Ca1 O6 130.99860(20) -8_556 . 1_555 N Ca6 Ca1 O6 48.8025(7) -8_556 . 2_555 N Ca6 Ca1 O6 60.9638(13) -8_556 . 3_555 N Ca6 Ca1 O6 49.00140(20) -8_556 . -1_555 N Ca6 Ca1 O6 131.1975(7) -8_556 . -2_555 N Ca6 Ca1 O6 119.0362(13) -8_556 . -3_555 N Ca6 Ca1 O6 60.9638(9) -12_655 . 1_555 N Ca6 Ca1 O6 130.9986(6) -12_655 . 2_555 N Ca6 Ca1 O6 48.8025(9) -12_655 . 3_555 N Ca6 Ca1 O6 119.0362(9) -12_655 . -1_555 N Ca6 Ca1 O6 49.0014(6) -12_655 . -2_555 N Ca6 Ca1 O6 131.1975(9) -12_655 . -3_555 N O6 Ca1 O6 98.7199 1_555 . 2_555 N O6 Ca1 O6 98.71990(30) 1_555 . 3_555 N O6 Ca1 O6 180.0 1_555 . -1_555 N O6 Ca1 O6 81.2801 1_555 . -2_555 N O6 Ca1 O6 81.28010(30) 1_555 . -3_555 N O6 Ca1 O6 98.71990(30) 2_555 . 3_555 N O6 Ca1 O6 81.2801 2_555 . -1_555 N O6 Ca1 O6 180.0 2_555 . -2_555 N O6 Ca1 O6 81.28010(30) 2_555 . -3_555 N O6 Ca1 O6 81.28010(30) 3_555 . -1_555 N O6 Ca1 O6 81.28010(30) 3_555 . -2_555 N O6 Ca1 O6 180.0 3_555 . -3_555 N O6 Ca1 O6 98.7199 -1_555 . -2_555 N O6 Ca1 O6 98.71990(30) -1_555 . -3_555 N O6 Ca1 O6 98.71990(30) -2_555 . -3_555 N Ca4 Ca2 Ca4 180.0 6_554 . 7_645 N Ca4 Ca2 Ca5 71.6286(21) 6_554 . 3_555 N Ca4 Ca2 Ca5 71.6287(10) 6_554 . 11_554 N Ca4 Ca2 Ca5 71.6286(11) 6_554 . 12_555 N Ca4 Ca2 Ca5 108.3714(21) 6_554 . -3_655 N Ca4 Ca2 Ca5 108.3714(10) 6_554 . -11_555 N Ca4 Ca2 Ca5 108.3714(11) 6_554 . -12_554 N Ca4 Ca2 O5 53.50530(10) 6_554 . 1_555 N Ca4 Ca2 O5 126.4948(9) 6_554 . 5_545 N Ca4 Ca2 O5 53.5053(10) 6_554 . 8_554 N Ca4 Ca2 O5 126.49480(10) 6_554 . -1_655 N Ca4 Ca2 O5 53.5053(9) 6_554 . -5_665 N Ca4 Ca2 O5 126.4948(10) 6_554 . -8_656 N Ca4 Ca2 Sr4 0.0 6_554 . 6_554 N Ca4 Ca2 Sr4 180.0 6_554 . 7_645 N Ca4 Ca2 Ce4 0.0 6_554 . 6_554 N Ca4 Ca2 Ce4 180.0 6_554 . 7_645 N Ca4 Ca2 Sr5 71.6286(21) 6_554 . 3_555 N Ca4 Ca2 Sr5 71.6287(10) 6_554 . 11_554 N Ca4 Ca2 Sr5 71.6286(11) 6_554 . 12_555 N Ca4 Ca2 Sr5 108.3714(21) 6_554 . -3_655 N Ca4 Ca2 Sr5 108.3714(10) 6_554 . -11_656 N Ca4 Ca2 Sr5 108.3714(11) 6_554 . -12_655 N Ca4 Ca2 Ce5 71.6286(21) 6_554 . 3_555 N Ca4 Ca2 Ca5 108.3713(21) 7_645 . 3_555 N Ca4 Ca2 Ca5 108.3714(10) 7_645 . 11_554 N Ca4 Ca2 Ca5 108.3714(11) 7_645 . 12_555 N Ca4 Ca2 Ca5 71.6286(21) 7_645 . -3_655 N Ca4 Ca2 Ca5 71.6286(10) 7_645 . -11_555 N Ca4 Ca2 Ca5 71.6286(11) 7_645 . -12_554 N Ca4 Ca2 O5 126.49470(10) 7_645 . 1_555 N Ca4 Ca2 O5 53.5053(9) 7_645 . 5_545 N Ca4 Ca2 O5 126.4948(10) 7_645 . 8_554 N Ca4 Ca2 O5 53.50530(10) 7_645 . -1_655 N Ca4 Ca2 O5 126.4947(9) 7_645 . -5_665 N Ca4 Ca2 O5 53.5052(10) 7_645 . -8_656 N Ca4 Ca2 Sr4 180.0 7_645 . 6_554 N Ca4 Ca2 Sr4 0.0 7_645 . 7_645 N Ca4 Ca2 Ce4 180.0 7_645 . 6_554 N Ca4 Ca2 Ce4 0.0 7_645 . 7_645 N Ca4 Ca2 Sr5 108.3713(21) 7_645 . 3_555 N Ca4 Ca2 Sr5 108.3714(10) 7_645 . 11_554 N Ca4 Ca2 Sr5 108.3714(11) 7_645 . 12_555 N Ca4 Ca2 Sr5 71.6286(21) 7_645 . -3_655 N Ca4 Ca2 Sr5 71.6286(10) 7_645 . -11_656 N Ca4 Ca2 Sr5 71.6286(11) 7_645 . -12_655 N Ca4 Ca2 Ce5 108.3713(21) 7_645 . 3_555 N Ca5 Ca2 Ca5 110.5483(10) 3_555 . 11_554 N Ca5 Ca2 Ca5 110.5483(11) 3_555 . 12_555 N Ca5 Ca2 Ca5 180.0 3_555 . -3_655 N Ca5 Ca2 Ca5 69.4517(10) 3_555 . -11_555 N Ca5 Ca2 Ca5 69.4517(11) 3_555 . -12_554 N Ca5 Ca2 O5 67.5689(8) 3_555 . 1_555 N Ca5 Ca2 O5 136.8334(4) 3_555 . 5_545 N Ca5 Ca2 O5 123.2704(12) 3_555 . 8_554 N Ca5 Ca2 O5 112.4311(8) 3_555 . -1_655 N Ca5 Ca2 O5 43.1666(4) 3_555 . -5_665 N Ca5 Ca2 O5 56.7296(12) 3_555 . -8_656 N Ca5 Ca2 Sr4 71.6286(21) 3_555 . 6_554 N Ca5 Ca2 Sr4 108.3713(21) 3_555 . 7_645 N Ca5 Ca2 Ce4 71.6286(21) 3_555 . 6_554 N Ca5 Ca2 Ce4 108.3713(21) 3_555 . 7_645 N Ca5 Ca2 Sr5 0.0 3_555 . 3_555 N Ca5 Ca2 Sr5 110.5483(10) 3_555 . 11_554 N Ca5 Ca2 Sr5 110.5483(11) 3_555 . 12_555 N Ca5 Ca2 Sr5 180.0 3_555 . -3_655 N Ca5 Ca2 Sr5 69.4517(10) 3_555 . -11_656 N Ca5 Ca2 Sr5 69.4517(11) 3_555 . -12_655 N Ca5 Ca2 Ce5 0.0 3_555 . 3_555 N Ca5 Ca2 Ca5 110.5483(21) 11_554 . 12_555 N Ca5 Ca2 Ca5 69.4517(10) 11_554 . -3_655 N Ca5 Ca2 Ca5 180.0 11_554 . -11_555 N Ca5 Ca2 Ca5 69.4517(21) 11_554 . -12_554 N Ca5 Ca2 O5 43.16660(20) 11_554 . 1_555 N Ca5 Ca2 O5 56.72960(10) 11_554 . 5_545 N Ca5 Ca2 O5 67.5689(15) 11_554 . 8_554 N Ca5 Ca2 O5 136.83350(20) 11_554 . -1_655 N Ca5 Ca2 O5 123.27040(10) 11_554 . -5_665 N Ca5 Ca2 O5 112.4311(15) 11_554 . -8_656 N Ca5 Ca2 Sr4 71.6287(10) 11_554 . 6_554 N Ca5 Ca2 Sr4 108.3714(10) 11_554 . 7_645 N Ca5 Ca2 Ce4 71.6287(10) 11_554 . 6_554 N Ca5 Ca2 Ce4 108.3714(10) 11_554 . 7_645 N Ca5 Ca2 Sr5 110.5483(10) 11_554 . 3_555 N Ca5 Ca2 Sr5 0.0 11_554 . 11_554 N Ca5 Ca2 Sr5 110.5483(21) 11_554 . 12_555 N Ca5 Ca2 Sr5 69.4517(10) 11_554 . -3_655 N Ca5 Ca2 Sr5 180.0 11_554 . -11_656 N Ca5 Ca2 Sr5 69.4517(21) 11_554 . -12_655 N Ca5 Ca2 Ce5 110.5483(10) 11_554 . 3_555 N Ca5 Ca2 Ca5 69.4517(11) 12_555 . -3_655 N Ca5 Ca2 Ca5 69.4517(21) 12_555 . -11_555 N Ca5 Ca2 Ca5 180.0 12_555 . -12_554 N Ca5 Ca2 O5 123.2704(11) 12_555 . 1_555 N Ca5 Ca2 O5 112.4311(6) 12_555 . 5_545 N Ca5 Ca2 O5 43.1666(6) 12_555 . 8_554 N Ca5 Ca2 O5 56.7296(11) 12_555 . -1_655 N Ca5 Ca2 O5 67.5689(6) 12_555 . -5_665 N Ca5 Ca2 O5 136.8334(6) 12_555 . -8_656 N Ca5 Ca2 Sr4 71.6286(11) 12_555 . 6_554 N Ca5 Ca2 Sr4 108.3714(11) 12_555 . 7_645 N Ca5 Ca2 Ce4 71.6286(11) 12_555 . 6_554 N Ca5 Ca2 Ce4 108.3714(11) 12_555 . 7_645 N Ca5 Ca2 Sr5 110.5483(11) 12_555 . 3_555 N Ca5 Ca2 Sr5 110.5483(21) 12_555 . 11_554 N Ca5 Ca2 Sr5 0.0 12_555 . 12_555 N Ca5 Ca2 Sr5 69.4517(11) 12_555 . -3_655 N Ca5 Ca2 Sr5 69.4517(21) 12_555 . -11_656 N Ca5 Ca2 Sr5 180.0 12_555 . -12_655 N Ca5 Ca2 Ce5 110.5483(11) 12_555 . 3_555 N Ca5 Ca2 Ca5 110.5483(10) -3_655 . -11_555 N Ca5 Ca2 Ca5 110.5483(11) -3_655 . -12_554 N Ca5 Ca2 O5 112.4311(8) -3_655 . 1_555 N Ca5 Ca2 O5 43.1666(4) -3_655 . 5_545 N Ca5 Ca2 O5 56.7296(12) -3_655 . 8_554 N Ca5 Ca2 O5 67.5689(8) -3_655 . -1_655 N Ca5 Ca2 O5 136.8334(4) -3_655 . -5_665 N Ca5 Ca2 O5 123.2704(12) -3_655 . -8_656 N Ca5 Ca2 Sr4 108.3714(21) -3_655 . 6_554 N Ca5 Ca2 Sr4 71.6286(21) -3_655 . 7_645 N Ca5 Ca2 Ce4 108.3714(21) -3_655 . 6_554 N Ca5 Ca2 Ce4 71.6286(21) -3_655 . 7_645 N Ca5 Ca2 Sr5 180.0 -3_655 . 3_555 N Ca5 Ca2 Sr5 69.4517(10) -3_655 . 11_554 N Ca5 Ca2 Sr5 69.4517(11) -3_655 . 12_555 N Ca5 Ca2 Sr5 0.0 -3_655 . -3_655 N Ca5 Ca2 Sr5 110.5483(10) -3_655 . -11_656 N Ca5 Ca2 Sr5 110.5483(11) -3_655 . -12_655 N Ca5 Ca2 Ce5 180.0 -3_655 . 3_555 N Ca5 Ca2 Ca5 110.5483(21) -11_555 . -12_554 N Ca5 Ca2 O5 136.83340(20) -11_656 . 1_555 N Ca5 Ca2 O5 123.27040(10) -11_656 . 5_545 N Ca5 Ca2 O5 112.4311(15) -11_656 . 8_554 N Ca5 Ca2 O5 43.16660(20) -11_656 . -1_655 N Ca5 Ca2 O5 56.72960(10) -11_656 . -5_665 N Ca5 Ca2 O5 67.5689(15) -11_656 . -8_656 N Ca5 Ca2 Sr4 108.3714(10) -11_656 . 6_554 N Ca5 Ca2 Sr4 71.6286(10) -11_656 . 7_645 N Ca5 Ca2 Ce4 108.3714(10) -11_656 . 6_554 N Ca5 Ca2 Ce4 71.6286(10) -11_656 . 7_645 N Ca5 Ca2 Sr5 69.4517(10) -11_656 . 3_555 N Ca5 Ca2 Sr5 180.0 -11_656 . 11_554 N Ca5 Ca2 Sr5 69.4517(21) -11_656 . 12_555 N Ca5 Ca2 Sr5 110.5483(10) -11_656 . -3_655 N Ca5 Ca2 Sr5 0.0 -11_656 . -11_656 N Ca5 Ca2 Sr5 110.5483(21) -11_656 . -12_655 N Ca5 Ca2 Ce5 69.4517(10) -11_656 . 3_555 N Ca5 Ca2 O5 56.7296(11) -12_655 . 1_555 N Ca5 Ca2 O5 67.5689(6) -12_655 . 5_545 N Ca5 Ca2 O5 136.8334(6) -12_655 . 8_554 N Ca5 Ca2 O5 123.2704(11) -12_655 . -1_655 N Ca5 Ca2 O5 112.4311(6) -12_655 . -5_665 N Ca5 Ca2 O5 43.1666(6) -12_655 . -8_656 N Ca5 Ca2 Sr4 108.3714(11) -12_655 . 6_554 N Ca5 Ca2 Sr4 71.6286(11) -12_655 . 7_645 N Ca5 Ca2 Ce4 108.3714(11) -12_655 . 6_554 N Ca5 Ca2 Ce4 71.6286(11) -12_655 . 7_645 N Ca5 Ca2 Sr5 69.4517(11) -12_655 . 3_555 N Ca5 Ca2 Sr5 69.4517(21) -12_655 . 11_554 N Ca5 Ca2 Sr5 180.0 -12_655 . 12_555 N Ca5 Ca2 Sr5 110.5483(11) -12_655 . -3_655 N Ca5 Ca2 Sr5 110.5483(21) -12_655 . -11_656 N Ca5 Ca2 Sr5 0.0 -12_655 . -12_655 N Ca5 Ca2 Ce5 69.4517(11) -12_655 . 3_555 N O5 Ca2 O5 91.75290(10) 1_555 . 5_545 N O5 Ca2 O5 88.2471(6) 1_555 . 8_554 N O5 Ca2 O5 180.0 1_555 . -1_655 N O5 Ca2 O5 88.24710(10) 1_555 . -5_665 N O5 Ca2 O5 91.7529(6) 1_555 . -8_656 N O5 Ca2 Sr4 53.50530(10) 1_555 . 6_554 N O5 Ca2 Sr4 126.49470(10) 1_555 . 7_645 N O5 Ca2 Ce4 53.50530(10) 1_555 . 6_554 N O5 Ca2 Ce4 126.49470(10) 1_555 . 7_645 N O5 Ca2 Sr5 67.5689(8) 1_555 . 3_555 N O5 Ca2 Sr5 43.16660(20) 1_555 . 11_554 N O5 Ca2 Sr5 123.2704(11) 1_555 . 12_555 N O5 Ca2 Sr5 112.4311(8) 1_555 . -3_655 N O5 Ca2 Sr5 136.83340(20) 1_555 . -11_656 N O5 Ca2 Sr5 56.7296(11) 1_555 . -12_655 N O5 Ca2 Ce5 67.5689(8) 1_555 . 3_555 N O5 Ca2 O5 91.7529(6) 5_545 . 8_554 N O5 Ca2 O5 88.24710(10) 5_545 . -1_655 N O5 Ca2 O5 180.0 5_545 . -5_665 N O5 Ca2 O5 88.2471(6) 5_545 . -8_656 N O5 Ca2 Sr4 126.4948(9) 5_545 . 6_554 N O5 Ca2 Sr4 53.5053(9) 5_545 . 7_645 N O5 Ca2 Ce4 126.4948(9) 5_545 . 6_554 N O5 Ca2 Ce4 53.5053(9) 5_545 . 7_645 N O5 Ca2 Sr5 136.8334(4) 5_545 . 3_555 N O5 Ca2 Sr5 56.72960(10) 5_545 . 11_554 N O5 Ca2 Sr5 112.4311(6) 5_545 . 12_555 N O5 Ca2 Sr5 43.1666(4) 5_545 . -3_655 N O5 Ca2 Sr5 123.27040(10) 5_545 . -11_656 N O5 Ca2 Sr5 67.5689(6) 5_545 . -12_655 N O5 Ca2 Ce5 136.8334(4) 5_545 . 3_555 N O5 Ca2 O5 91.7530(6) 8_554 . -1_655 N O5 Ca2 O5 88.2471(6) 8_554 . -5_665 N O5 Ca2 O5 180.0 8_554 . -8_656 N O5 Ca2 Sr4 53.5053(10) 8_554 . 6_554 N O5 Ca2 Sr4 126.4948(10) 8_554 . 7_645 N O5 Ca2 Ce4 53.5053(10) 8_554 . 6_554 N O5 Ca2 Ce4 126.4948(10) 8_554 . 7_645 N O5 Ca2 Sr5 123.2704(12) 8_554 . 3_555 N O5 Ca2 Sr5 67.5689(15) 8_554 . 11_554 N O5 Ca2 Sr5 43.1666(6) 8_554 . 12_555 N O5 Ca2 Sr5 56.7296(12) 8_554 . -3_655 N O5 Ca2 Sr5 112.4311(15) 8_554 . -11_656 N O5 Ca2 Sr5 136.8334(6) 8_554 . -12_655 N O5 Ca2 Ce5 123.2704(12) 8_554 . 3_555 N O5 Ca2 O5 91.75290(10) -1_655 . -5_665 N O5 Ca2 O5 88.2471(6) -1_655 . -8_656 N O5 Ca2 Sr4 126.49480(10) -1_655 . 6_554 N O5 Ca2 Sr4 53.50530(10) -1_655 . 7_645 N O5 Ca2 Ce4 126.49480(10) -1_655 . 6_554 N O5 Ca2 Ce4 53.50530(10) -1_655 . 7_645 N O5 Ca2 Sr5 112.4311(8) -1_655 . 3_555 N O5 Ca2 Sr5 136.83350(20) -1_655 . 11_554 N O5 Ca2 Sr5 56.7296(11) -1_655 . 12_555 N O5 Ca2 Sr5 67.5689(8) -1_655 . -3_655 N O5 Ca2 Sr5 43.16660(20) -1_655 . -11_656 N O5 Ca2 Sr5 123.2704(11) -1_655 . -12_655 N O5 Ca2 Ce5 112.4311(8) -1_655 . 3_555 N O5 Ca2 O5 91.7529(6) -5_665 . -8_656 N O5 Ca2 Sr4 53.5053(9) -5_665 . 6_554 N O5 Ca2 Sr4 126.4947(9) -5_665 . 7_645 N O5 Ca2 Ce4 53.5053(9) -5_665 . 6_554 N O5 Ca2 Ce4 126.4947(9) -5_665 . 7_645 N O5 Ca2 Sr5 43.1666(4) -5_665 . 3_555 N O5 Ca2 Sr5 123.27040(10) -5_665 . 11_554 N O5 Ca2 Sr5 67.5689(6) -5_665 . 12_555 N O5 Ca2 Sr5 136.8334(4) -5_665 . -3_655 N O5 Ca2 Sr5 56.72960(10) -5_665 . -11_656 N O5 Ca2 Sr5 112.4311(6) -5_665 . -12_655 N O5 Ca2 Ce5 43.1666(4) -5_665 . 3_555 N O5 Ca2 Sr4 126.4948(10) -8_656 . 6_554 N O5 Ca2 Sr4 53.5052(10) -8_656 . 7_645 N O5 Ca2 Ce4 126.4948(10) -8_656 . 6_554 N O5 Ca2 Ce4 53.5052(10) -8_656 . 7_645 N O5 Ca2 Sr5 56.7296(12) -8_656 . 3_555 N O5 Ca2 Sr5 112.4311(15) -8_656 . 11_554 N O5 Ca2 Sr5 136.8334(6) -8_656 . 12_555 N O5 Ca2 Sr5 123.2704(12) -8_656 . -3_655 N O5 Ca2 Sr5 67.5689(15) -8_656 . -11_656 N O5 Ca2 Sr5 43.1666(6) -8_656 . -12_655 N O5 Ca2 Ce5 56.7296(12) -8_656 . 3_555 N Sr4 Ca2 Sr4 180.0 6_554 . 7_645 N Sr4 Ca2 Ce4 0.0 6_554 . 6_554 N Sr4 Ca2 Ce4 180.0 6_554 . 7_645 N Sr4 Ca2 Sr5 71.6286(21) 6_554 . 3_555 N Sr4 Ca2 Sr5 71.6287(10) 6_554 . 11_554 N Sr4 Ca2 Sr5 71.6286(11) 6_554 . 12_555 N Sr4 Ca2 Sr5 108.3714(21) 6_554 . -3_655 N Sr4 Ca2 Sr5 108.3714(10) 6_554 . -11_656 N Sr4 Ca2 Sr5 108.3714(11) 6_554 . -12_655 N Sr4 Ca2 Ce5 71.6286(21) 6_554 . 3_555 N Sr4 Ca2 Ce4 180.0 7_645 . 6_554 N Sr4 Ca2 Ce4 0.0 7_645 . 7_645 N Sr4 Ca2 Sr5 108.3713(21) 7_645 . 3_555 N Sr4 Ca2 Sr5 108.3714(10) 7_645 . 11_554 N Sr4 Ca2 Sr5 108.3714(11) 7_645 . 12_555 N Sr4 Ca2 Sr5 71.6286(21) 7_645 . -3_655 N Sr4 Ca2 Sr5 71.6286(10) 7_645 . -11_656 N Sr4 Ca2 Sr5 71.6286(11) 7_645 . -12_655 N Sr4 Ca2 Ce5 108.3713(21) 7_645 . 3_555 N Ce4 Ca2 Ce4 180.0 6_554 . 7_645 N Ce4 Ca2 Sr5 71.6286(21) 6_554 . 3_555 N Ce4 Ca2 Sr5 71.6287(10) 6_554 . 11_554 N Ce4 Ca2 Sr5 71.6286(11) 6_554 . 12_555 N Ce4 Ca2 Sr5 108.3714(21) 6_554 . -3_655 N Ce4 Ca2 Sr5 108.3714(10) 6_554 . -11_656 N Ce4 Ca2 Sr5 108.3714(11) 6_554 . -12_655 N Ce4 Ca2 Ce5 71.6286(21) 6_554 . 3_555 N Ce4 Ca2 Sr5 108.3713(21) 7_645 . 3_555 N Ce4 Ca2 Sr5 108.3714(10) 7_645 . 11_554 N Ce4 Ca2 Sr5 108.3714(11) 7_645 . 12_555 N Ce4 Ca2 Sr5 71.6286(21) 7_645 . -3_655 N Ce4 Ca2 Sr5 71.6286(10) 7_645 . -11_656 N Ce4 Ca2 Sr5 71.6286(11) 7_645 . -12_655 N Ce4 Ca2 Ce5 108.3713(21) 7_645 . 3_555 N Sr5 Ca2 Sr5 110.5483(10) 3_555 . 11_554 N Sr5 Ca2 Sr5 110.5483(11) 3_555 . 12_555 N Sr5 Ca2 Sr5 180.0 3_555 . -3_655 N Sr5 Ca2 Sr5 69.4517(10) 3_555 . -11_656 N Sr5 Ca2 Sr5 69.4517(11) 3_555 . -12_655 N Sr5 Ca2 Ce5 0.0 3_555 . 3_555 N Sr5 Ca2 Sr5 110.5483(21) 11_554 . 12_555 N Sr5 Ca2 Sr5 69.4517(10) 11_554 . -3_655 N Sr5 Ca2 Sr5 180.0 11_554 . -11_656 N Sr5 Ca2 Sr5 69.4517(21) 11_554 . -12_655 N Sr5 Ca2 Ce5 110.5483(10) 11_554 . 3_555 N Sr5 Ca2 Sr5 69.4517(11) 12_555 . -3_655 N Sr5 Ca2 Sr5 69.4517(21) 12_555 . -11_656 N Sr5 Ca2 Sr5 180.0 12_555 . -12_655 N Sr5 Ca2 Ce5 110.5483(11) 12_555 . 3_555 N Sr5 Ca2 Sr5 110.5483(10) -3_655 . -11_656 N Sr5 Ca2 Sr5 110.5483(11) -3_655 . -12_655 N Sr5 Ca2 Ce5 180.0 -3_655 . 3_555 N Sr5 Ca2 Sr5 110.5483(21) -11_656 . -12_655 N Sr5 Ca2 Ce5 69.4517(10) -11_656 . 3_555 N Sr5 Ca2 Ce5 69.4517(11) -12_655 . 3_555 N Ca4 Ca3 Ca5 111.7519(11) 1_555 . 1_555 N Ca4 Ca3 Ca5 111.7519(21) 1_555 . 2_555 N Ca4 Ca3 Ca5 111.7519(10) 1_555 . 3_555 N Ca4 Ca3 Ca6 73.5491(22) 1_555 . 1_555 N Ca4 Ca3 Ca6 73.5491(11) 1_555 . 2_555 N Ca4 Ca3 Ca6 73.5491(11) 1_555 . 3_555 N Ca4 Ca3 O3 112.4069(15) 1_555 . 1_555 N Ca4 Ca3 O3 112.4069(10) 1_555 . 2_555 N Ca4 Ca3 O3 112.4069(5) 1_555 . 3_555 N Ca4 Ca3 O4 55.00000(20) 1_555 . 1_555 N Ca4 Ca3 O4 55.0000(11) 1_555 . 2_555 N Ca4 Ca3 O4 55.0000(12) 1_555 . 3_555 N Ca4 Ca3 Sr4 0.0 1_555 . 1_555 N Ca4 Ca3 Ce4 0.0 1_555 . 1_555 N Ca4 Ca3 Sr5 111.7519(11) 1_555 . 1_555 N Ca4 Ca3 Sr5 111.7519(21) 1_555 . 2_555 N Ca4 Ca3 Sr5 111.7519(10) 1_555 . 3_555 N Ca4 Ca3 Ce5 111.7519(11) 1_555 . 1_555 N Ca4 Ca3 Ce5 111.7519(21) 1_555 . 2_555 N Ca4 Ca3 Ce5 111.7519(10) 1_555 . 3_555 N Ca5 Ca3 Ca5 107.0974(11) 1_555 . 2_555 N Ca5 Ca3 Ca5 107.0974(21) 1_555 . 3_555 N Ca5 Ca3 Ca6 69.9340(12) 1_555 . 1_555 N Ca5 Ca3 Ca6 70.2589(21) 1_555 . 2_555 N Ca5 Ca3 Ca6 174.6957 1_555 . 3_555 N Ca5 Ca3 O3 48.4064(9) 1_555 . 1_555 N Ca5 Ca3 O3 61.9637(12) 1_555 . 2_555 N Ca5 Ca3 O3 135.2422(5) 1_555 . 3_555 N Ca5 Ca3 O4 60.8102(13) 1_555 . 1_555 N Ca5 Ca3 O4 145.1154(4) 1_555 . 2_555 N Ca5 Ca3 O4 107.7630(9) 1_555 . 3_555 N Ca5 Ca3 Sr4 111.7519(11) 1_555 . 1_555 N Ca5 Ca3 Ce4 111.7519(11) 1_555 . 1_555 N Ca5 Ca3 Sr5 0.0 1_555 . 1_555 N Ca5 Ca3 Sr5 107.0974(11) 1_555 . 2_555 N Ca5 Ca3 Sr5 107.0974(21) 1_555 . 3_555 N Ca5 Ca3 Ce5 0.0 1_555 . 1_555 N Ca5 Ca3 Ce5 107.0974(11) 1_555 . 2_555 N Ca5 Ca3 Ce5 107.0974(21) 1_555 . 3_555 N Ca5 Ca3 Ca5 107.0974(11) 2_555 . 3_555 N Ca5 Ca3 Ca6 174.69569(10) 2_555 . 1_555 N Ca5 Ca3 Ca6 69.9340(9) 2_555 . 2_555 N Ca5 Ca3 Ca6 70.2589(10) 2_555 . 3_555 N Ca5 Ca3 O3 135.2422(6) 2_555 . 1_555 N Ca5 Ca3 O3 48.40640(10) 2_555 . 2_555 N Ca5 Ca3 O3 61.96370(20) 2_555 . 3_555 N Ca5 Ca3 O4 107.7630(9) 2_555 . 1_555 N Ca5 Ca3 O4 60.8102(12) 2_555 . 2_555 N Ca5 Ca3 O4 145.11540(20) 2_555 . 3_555 N Ca5 Ca3 Sr4 111.7519(21) 2_555 . 1_555 N Ca5 Ca3 Ce4 111.7519(21) 2_555 . 1_555 N Ca5 Ca3 Sr5 107.0974(11) 2_555 . 1_555 N Ca5 Ca3 Sr5 0.0 2_555 . 2_555 N Ca5 Ca3 Sr5 107.0974(11) 2_555 . 3_555 N Ca5 Ca3 Ce5 107.0974(11) 2_555 . 1_555 N Ca5 Ca3 Ce5 0.0 2_555 . 2_555 N Ca5 Ca3 Ce5 107.0974(11) 2_555 . 3_555 N Ca5 Ca3 Ca6 70.2589(12) 3_555 . 1_555 N Ca5 Ca3 Ca6 174.6957 3_555 . 2_555 N Ca5 Ca3 Ca6 69.9340(21) 3_555 . 3_555 N Ca5 Ca3 O3 61.9637(14) 3_555 . 1_555 N Ca5 Ca3 O3 135.2422 3_555 . 2_555 N Ca5 Ca3 O3 48.4064(10) 3_555 . 3_555 N Ca5 Ca3 O4 145.11540(20) 3_555 . 1_555 N Ca5 Ca3 O4 107.7630(17) 3_555 . 2_555 N Ca5 Ca3 O4 60.81020(10) 3_555 . 3_555 N Ca5 Ca3 Sr4 111.7519(10) 3_555 . 1_555 N Ca5 Ca3 Ce4 111.7519(10) 3_555 . 1_555 N Ca5 Ca3 Sr5 107.0974(21) 3_555 . 1_555 N Ca5 Ca3 Sr5 107.0974(11) 3_555 . 2_555 N Ca5 Ca3 Sr5 0.0 3_555 . 3_555 N Ca5 Ca3 Ce5 107.0974(21) 3_555 . 1_555 N Ca5 Ca3 Ce5 107.0974(11) 3_555 . 2_555 N Ca5 Ca3 Ce5 0.0 3_555 . 3_555 N Ca6 Ca3 Ca6 112.3153(10) 1_555 . 2_555 N Ca6 Ca3 Ca6 112.3153(10) 1_555 . 3_555 N Ca6 Ca3 O3 39.5077(6) 1_555 . 1_555 N Ca6 Ca3 O3 130.175 1_555 . 2_555 N Ca6 Ca3 O3 116.76030(20) 1_555 . 3_555 N Ca6 Ca3 O4 74.8907(10) 1_555 . 1_555 N Ca6 Ca3 O4 124.1741(12) 1_555 . 2_555 N Ca6 Ca3 O4 37.96890(30) 1_555 . 3_555 N Ca6 Ca3 Sr4 73.5491(22) 1_555 . 1_555 N Ca6 Ca3 Ce4 73.5491(22) 1_555 . 1_555 N Ca6 Ca3 Sr5 69.9340(12) 1_555 . 1_555 N Ca6 Ca3 Sr5 174.69569(10) 1_555 . 2_555 N Ca6 Ca3 Sr5 70.2589(12) 1_555 . 3_555 N Ca6 Ca3 Ce5 69.9340(12) 1_555 . 1_555 N Ca6 Ca3 Ce5 174.69569(10) 1_555 . 2_555 N Ca6 Ca3 Ce5 70.2589(12) 1_555 . 3_555 N Ca6 Ca3 Ca6 112.3153(21) 2_555 . 3_555 N Ca6 Ca3 O3 116.7603(13) 2_555 . 1_555 N Ca6 Ca3 O3 39.50770(10) 2_555 . 2_555 N Ca6 Ca3 O3 130.1750(8) 2_555 . 3_555 N Ca6 Ca3 O4 37.96890(10) 2_555 . 1_555 N Ca6 Ca3 O4 74.8907(17) 2_555 . 2_555 N Ca6 Ca3 O4 124.17410(10) 2_555 . 3_555 N Ca6 Ca3 Sr4 73.5491(11) 2_555 . 1_555 N Ca6 Ca3 Ce4 73.5491(11) 2_555 . 1_555 N Ca6 Ca3 Sr5 70.2589(21) 2_555 . 1_555 N Ca6 Ca3 Sr5 69.9340(9) 2_555 . 2_555 N Ca6 Ca3 Sr5 174.6957 2_555 . 3_555 N Ca6 Ca3 Ce5 70.2589(21) 2_555 . 1_555 N Ca6 Ca3 Ce5 69.9340(9) 2_555 . 2_555 N Ca6 Ca3 Ce5 174.6957 2_555 . 3_555 N Ca6 Ca3 O3 130.1750(8) 3_555 . 1_555 N Ca6 Ca3 O3 116.7603(11) 3_555 . 2_555 N Ca6 Ca3 O3 39.5077(6) 3_555 . 3_555 N Ca6 Ca3 O4 124.1741(13) 3_555 . 1_555 N Ca6 Ca3 O4 37.9689(4) 3_555 . 2_555 N Ca6 Ca3 O4 74.8907(7) 3_555 . 3_555 N Ca6 Ca3 Sr4 73.5491(11) 3_555 . 1_555 N Ca6 Ca3 Ce4 73.5491(11) 3_555 . 1_555 N Ca6 Ca3 Sr5 174.6957 3_555 . 1_555 N Ca6 Ca3 Sr5 70.2589(10) 3_555 . 2_555 N Ca6 Ca3 Sr5 69.9340(21) 3_555 . 3_555 N Ca6 Ca3 Ce5 174.6957 3_555 . 1_555 N Ca6 Ca3 Ce5 70.2589(10) 3_555 . 2_555 N Ca6 Ca3 Ce5 69.9340(21) 3_555 . 3_555 N O3 Ca3 O3 106.3826(4) 1_555 . 2_555 N O3 Ca3 O3 106.38260(30) 1_555 . 3_555 N O3 Ca3 O4 91.6833(10) 1_555 . 1_555 N O3 Ca3 O4 161.4963(7) 1_555 . 2_555 N O3 Ca3 O4 71.23020(20) 1_555 . 3_555 N O3 Ca3 Sr4 112.4069(15) 1_555 . 1_555 N O3 Ca3 Ce4 112.4069(15) 1_555 . 1_555 N O3 Ca3 Sr5 48.4064(9) 1_555 . 1_555 N O3 Ca3 Sr5 135.2422(6) 1_555 . 2_555 N O3 Ca3 Sr5 61.9637(14) 1_555 . 3_555 N O3 Ca3 Ce5 48.4064(9) 1_555 . 1_555 N O3 Ca3 Ce5 135.2422(6) 1_555 . 2_555 N O3 Ca3 Ce5 61.9637(14) 1_555 . 3_555 N O3 Ca3 O3 106.38260(10) 2_555 . 3_555 N O3 Ca3 O4 71.23020(20) 2_555 . 1_555 N O3 Ca3 O4 91.6833(11) 2_555 . 2_555 N O3 Ca3 O4 161.4963 2_555 . 3_555 N O3 Ca3 Sr4 112.4069(10) 2_555 . 1_555 N O3 Ca3 Ce4 112.4069(10) 2_555 . 1_555 N O3 Ca3 Sr5 61.9637(12) 2_555 . 1_555 N O3 Ca3 Sr5 48.40640(10) 2_555 . 2_555 N O3 Ca3 Sr5 135.2422 2_555 . 3_555 N O3 Ca3 Ce5 61.9637(12) 2_555 . 1_555 N O3 Ca3 Ce5 48.40640(10) 2_555 . 2_555 N O3 Ca3 Ce5 135.2422 2_555 . 3_555 N O3 Ca3 O4 161.4963(7) 3_555 . 1_555 N O3 Ca3 O4 71.2302(4) 3_555 . 2_555 N O3 Ca3 O4 91.68330(10) 3_555 . 3_555 N O3 Ca3 Sr4 112.4069(5) 3_555 . 1_555 N O3 Ca3 Ce4 112.4069(5) 3_555 . 1_555 N O3 Ca3 Sr5 135.2422(5) 3_555 . 1_555 N O3 Ca3 Sr5 61.96370(20) 3_555 . 2_555 N O3 Ca3 Sr5 48.4064(10) 3_555 . 3_555 N O3 Ca3 Ce5 135.2422(5) 3_555 . 1_555 N O3 Ca3 Ce5 61.96370(20) 3_555 . 2_555 N O3 Ca3 Ce5 48.4064(10) 3_555 . 3_555 N O4 Ca3 O4 90.3734(11) 1_555 . 2_555 N O4 Ca3 O4 90.37340(20) 1_555 . 3_555 N O4 Ca3 Sr4 55.00000(20) 1_555 . 1_555 N O4 Ca3 Ce4 55.00000(20) 1_555 . 1_555 N O4 Ca3 Sr5 60.8102(13) 1_555 . 1_555 N O4 Ca3 Sr5 107.7630(9) 1_555 . 2_555 N O4 Ca3 Sr5 145.11540(20) 1_555 . 3_555 N O4 Ca3 Ce5 60.8102(13) 1_555 . 1_555 N O4 Ca3 Ce5 107.7630(9) 1_555 . 2_555 N O4 Ca3 Ce5 145.11540(20) 1_555 . 3_555 N O4 Ca3 O4 90.3734(8) 2_555 . 3_555 N O4 Ca3 Sr4 55.0000(11) 2_555 . 1_555 N O4 Ca3 Ce4 55.0000(11) 2_555 . 1_555 N O4 Ca3 Sr5 145.1154(4) 2_555 . 1_555 N O4 Ca3 Sr5 60.8102(12) 2_555 . 2_555 N O4 Ca3 Sr5 107.7630(17) 2_555 . 3_555 N O4 Ca3 Ce5 145.1154(4) 2_555 . 1_555 N O4 Ca3 Ce5 60.8102(12) 2_555 . 2_555 N O4 Ca3 Ce5 107.7630(17) 2_555 . 3_555 N O4 Ca3 Sr4 55.0000(12) 3_555 . 1_555 N O4 Ca3 Ce4 55.0000(12) 3_555 . 1_555 N O4 Ca3 Sr5 107.7630(9) 3_555 . 1_555 N O4 Ca3 Sr5 145.11540(20) 3_555 . 2_555 N O4 Ca3 Sr5 60.81020(10) 3_555 . 3_555 N O4 Ca3 Ce5 107.7630(9) 3_555 . 1_555 N O4 Ca3 Ce5 145.11540(20) 3_555 . 2_555 N O4 Ca3 Ce5 60.81020(10) 3_555 . 3_555 N Sr4 Ca3 Ce4 0.0 1_555 . 1_555 N Sr4 Ca3 Sr5 111.7519(11) 1_555 . 1_555 N Sr4 Ca3 Sr5 111.7519(21) 1_555 . 2_555 N Sr4 Ca3 Sr5 111.7519(10) 1_555 . 3_555 N Sr4 Ca3 Ce5 111.7519(11) 1_555 . 1_555 N Sr4 Ca3 Ce5 111.7519(21) 1_555 . 2_555 N Sr4 Ca3 Ce5 111.7519(10) 1_555 . 3_555 N Ce4 Ca3 Sr5 111.7519(11) 1_555 . 1_555 N Ce4 Ca3 Sr5 111.7519(21) 1_555 . 2_555 N Ce4 Ca3 Sr5 111.7519(10) 1_555 . 3_555 N Ce4 Ca3 Ce5 111.7519(11) 1_555 . 1_555 N Ce4 Ca3 Ce5 111.7519(21) 1_555 . 2_555 N Ce4 Ca3 Ce5 111.7519(10) 1_555 . 3_555 N Sr5 Ca3 Sr5 107.0974(11) 1_555 . 2_555 N Sr5 Ca3 Sr5 107.0974(21) 1_555 . 3_555 N Sr5 Ca3 Ce5 0.0 1_555 . 1_555 N Sr5 Ca3 Ce5 107.0974(11) 1_555 . 2_555 N Sr5 Ca3 Ce5 107.0974(21) 1_555 . 3_555 N Sr5 Ca3 Sr5 107.0974(11) 2_555 . 3_555 N Sr5 Ca3 Ce5 107.0974(11) 2_555 . 1_555 N Sr5 Ca3 Ce5 0.0 2_555 . 2_555 N Sr5 Ca3 Ce5 107.0974(11) 2_555 . 3_555 N Sr5 Ca3 Ce5 107.0974(21) 3_555 . 1_555 N Sr5 Ca3 Ce5 107.0974(11) 3_555 . 2_555 N Sr5 Ca3 Ce5 0.0 3_555 . 3_555 N Ce5 Ca3 Ce5 107.0974(11) 1_555 . 2_555 N Ce5 Ca3 Ce5 107.0974(21) 1_555 . 3_555 N Ce5 Ca3 Ce5 107.0974(11) 2_555 . 3_555 N Ca2 Ca4 Ca3 180.0 9_556 . 1_555 N Ca2 Ca4 Al1 73.3611(21) 9_556 . -9_654 N Ca2 Ca4 Al1 73.3611(12) 9_556 . -10_555 N Ca2 Ca4 Al1 73.3611(10) 9_556 . -11_645 N Ca2 Ca4 O1 95.3318(17) 9_556 . -9_555 N Ca2 Ca4 O1 95.3318(19) 9_556 . -10_456 N Ca2 Ca4 O1 95.33180(30) 9_556 . -11_546 N Ca2 Ca4 O4 131.6605(5) 9_556 . 1_555 N Ca2 Ca4 O4 131.6605(14) 9_556 . 2_555 N Ca2 Ca4 O4 131.6605(8) 9_556 . 3_555 N Ca2 Ca4 O5 51.6735(16) 9_556 . -9_665 N Ca2 Ca4 O5 51.6735(7) 9_556 . -10_566 N Ca2 Ca4 O5 51.6735(9) 9_556 . -11_656 N Ca2 Ca4 Li2 0.0 9_556 . 9_556 N Ca2 Ca4 Li3 180.0 9_556 . 1_555 N Ca2 Ca4 Sr5 58.4891(6) 9_556 . 4_555 N Ca2 Ca4 Sr5 58.4891(6) 9_556 . 5_555 N Ca2 Ca4 Sr5 58.4891(12) 9_556 . 6_555 N Ca3 Ca4 Al1 106.6389(21) 1_555 . -9_654 N Ca3 Ca4 Al1 106.6389(12) 1_555 . -10_555 N Ca3 Ca4 Al1 106.6389(10) 1_555 . -11_645 N Ca3 Ca4 O1 84.6682(17) 1_555 . -9_555 N Ca3 Ca4 O1 84.6682(19) 1_555 . -10_456 N Ca3 Ca4 O1 84.66820(30) 1_555 . -11_546 N Ca3 Ca4 O4 48.3395(5) 1_555 . 1_555 N Ca3 Ca4 O4 48.3395(14) 1_555 . 2_555 N Ca3 Ca4 O4 48.3395(8) 1_555 . 3_555 N Ca3 Ca4 O5 128.3264(16) 1_555 . -9_665 N Ca3 Ca4 O5 128.3264(7) 1_555 . -10_566 N Ca3 Ca4 O5 128.3264(9) 1_555 . -11_656 N Ca3 Ca4 Li2 180.0 1_555 . 9_556 N Ca3 Ca4 Li3 0.0 1_555 . 1_555 N Ca3 Ca4 Sr5 121.5109(6) 1_555 . 4_555 N Ca3 Ca4 Sr5 121.5109(6) 1_555 . 5_555 N Ca3 Ca4 Sr5 121.5109(12) 1_555 . 6_555 N Al1 Ca4 Al1 112.1489(11) -9_654 . -10_555 N Al1 Ca4 Al1 112.1489(9) -9_654 . -11_645 N Al1 Ca4 O1 38.0997(7) -9_555 . -9_555 N Al1 Ca4 O1 149.8661(5) -9_555 . -10_456 N Al1 Ca4 O1 90.10930(30) -9_555 . -11_546 N Al1 Ca4 O4 93.1637(14) -9_665 . 1_555 N Al1 Ca4 O4 150.0741(6) -9_665 . 2_555 N Al1 Ca4 O4 69.4603(16) -9_665 . 3_555 N Al1 Ca4 O5 26.5391(4) -9_665 . -9_665 N Al1 Ca4 O5 89.1853(15) -9_665 . -10_566 N Al1 Ca4 O5 112.0946(15) -9_665 . -11_656 N Al1 Ca4 Li2 73.3611(21) -9_665 . 9_556 N Al1 Ca4 Li3 106.6389(21) -9_665 . 1_555 N Al1 Ca4 Sr5 57.94250(30) -9_665 . 4_555 N Al1 Ca4 Sr5 54.2115(5) -9_665 . 5_555 N Al1 Ca4 Sr5 131.8044(9) -9_665 . 6_555 N Al1 Ca4 Al1 112.1489(21) -10_555 . -11_645 N Al1 Ca4 O1 90.1093(19) -10_456 . -9_555 N Al1 Ca4 O1 38.0997(6) -10_456 . -10_456 N Al1 Ca4 O1 149.8661(8) -10_456 . -11_546 N Al1 Ca4 O4 69.4603(18) -10_566 . 1_555 N Al1 Ca4 O4 93.1637(5) -10_566 . 2_555 N Al1 Ca4 O4 150.07410(30) -10_566 . 3_555 N Al1 Ca4 O5 112.0946(4) -10_566 . -9_665 N Al1 Ca4 O5 26.53910(30) -10_566 . -10_566 N Al1 Ca4 O5 89.1853(21) -10_566 . -11_656 N Al1 Ca4 Li2 73.3611(12) -10_566 . 9_556 N Al1 Ca4 Li3 106.6389(12) -10_566 . 1_555 N Al1 Ca4 Sr5 131.8044(5) -10_566 . 4_555 N Al1 Ca4 Sr5 57.9425(6) -10_566 . 5_555 N Al1 Ca4 Sr5 54.2115(11) -10_566 . 6_555 N Al1 Ca4 O1 149.86610(30) -11_546 . -9_555 N Al1 Ca4 O1 90.1093(16) -11_546 . -10_456 N Al1 Ca4 O1 38.0997(13) -11_546 . -11_546 N Al1 Ca4 O4 150.07410(30) -11_656 . 1_555 N Al1 Ca4 O4 69.46030(20) -11_656 . 2_555 N Al1 Ca4 O4 93.1637(19) -11_656 . 3_555 N Al1 Ca4 O5 89.1853(6) -11_656 . -9_665 N Al1 Ca4 O5 112.0946(18) -11_656 . -10_566 N Al1 Ca4 O5 26.53910(10) -11_656 . -11_656 N Al1 Ca4 Li2 73.3611(10) -11_656 . 9_556 N Al1 Ca4 Li3 106.6389(10) -11_656 . 1_555 N Al1 Ca4 Sr5 54.2115(6) -11_656 . 4_555 N Al1 Ca4 Sr5 131.8044(4) -11_656 . 5_555 N Al1 Ca4 Sr5 57.9425(9) -11_656 . 6_555 N O1 Ca4 O1 119.1467(13) -9_555 . -10_456 N O1 Ca4 O1 119.1467(11) -9_555 . -11_546 N O1 Ca4 O4 55.7340(7) -9_665 . 1_555 N O1 Ca4 O4 131.66980(30) -9_665 . 2_555 N O1 Ca4 O4 73.3153(21) -9_665 . 3_555 N O1 Ca4 O5 62.90150(30) -9_665 . -9_665 N O1 Ca4 O5 78.7090(21) -9_665 . -10_566 N O1 Ca4 O5 145.5067(8) -9_665 . -11_656 N O1 Ca4 Li2 95.3318(17) -9_665 . 9_556 N O1 Ca4 Li3 84.6682(17) -9_665 . 1_555 N O1 Ca4 Sr5 95.90810(30) -9_665 . 4_555 N O1 Ca4 Sr5 44.5831(10) -9_665 . 5_555 N O1 Ca4 Sr5 139.0257(10) -9_665 . 6_555 N O1 Ca4 O1 119.14670(20) -10_456 . -11_546 N O1 Ca4 O4 73.3153(19) -10_566 . 1_555 N O1 Ca4 O4 55.73400(10) -10_566 . 2_555 N O1 Ca4 O4 131.6698(11) -10_566 . 3_555 N O1 Ca4 O5 145.50670(30) -10_566 . -9_665 N O1 Ca4 O5 62.9015(10) -10_566 . -10_566 N O1 Ca4 O5 78.7090(20) -10_566 . -11_656 N O1 Ca4 Li2 95.3318(19) -10_566 . 9_556 N O1 Ca4 Li3 84.6682(19) -10_566 . 1_555 N O1 Ca4 Sr5 139.0257(9) -10_566 . 4_555 N O1 Ca4 Sr5 95.9081 -10_566 . 5_555 N O1 Ca4 Sr5 44.5831(10) -10_566 . 6_555 N O1 Ca4 O4 131.6698(8) -11_656 . 1_555 N O1 Ca4 O4 73.31530(10) -11_656 . 2_555 N O1 Ca4 O4 55.7340(6) -11_656 . 3_555 N O1 Ca4 O5 78.70900(10) -11_656 . -9_665 N O1 Ca4 O5 145.5067(5) -11_656 . -10_566 N O1 Ca4 O5 62.9015(13) -11_656 . -11_656 N O1 Ca4 Li2 95.33180(30) -11_656 . 9_556 N O1 Ca4 Li3 84.66820(30) -11_656 . 1_555 N O1 Ca4 Sr5 44.5831 -11_656 . 4_555 N O1 Ca4 Sr5 139.02570(10) -11_656 . 5_555 N O1 Ca4 Sr5 95.90810(30) -11_656 . 6_555 N O4 Ca4 O4 80.6322(5) 1_555 . 2_555 N O4 Ca4 O4 80.6322(15) 1_555 . 3_555 N O4 Ca4 O5 118.6349(10) 1_555 . -9_665 N O4 Ca4 O5 82.7888(13) 1_555 . -10_566 N O4 Ca4 O5 152.00070(10) 1_555 . -11_656 N O4 Ca4 Li2 131.6605(5) 1_555 . 9_556 N O4 Ca4 Li3 48.3395(5) 1_555 . 1_555 N O4 Ca4 Sr5 147.6226(10) 1_555 . 4_555 N O4 Ca4 Sr5 75.76030(10) 1_555 . 5_555 N O4 Ca4 Sr5 116.3403(10) 1_555 . 6_555 N O4 Ca4 O4 80.6322(10) 2_555 . 3_555 N O4 Ca4 O5 152.0007 2_555 . -9_665 N O4 Ca4 O5 118.6349(9) 2_555 . -10_566 N O4 Ca4 O5 82.7888(5) 2_555 . -11_656 N O4 Ca4 Li2 131.6605(14) 2_555 . 9_556 N O4 Ca4 Li3 48.3395(14) 2_555 . 1_555 N O4 Ca4 Sr5 116.3403 2_555 . 4_555 N O4 Ca4 Sr5 147.62260(10) 2_555 . 5_555 N O4 Ca4 Sr5 75.76030(20) 2_555 . 6_555 N O4 Ca4 O5 82.7888(8) 3_555 . -9_665 N O4 Ca4 O5 152.00070(10) 3_555 . -10_566 N O4 Ca4 O5 118.6349(19) 3_555 . -11_656 N O4 Ca4 Li2 131.6605(8) 3_555 . 9_556 N O4 Ca4 Li3 48.3395(8) 3_555 . 1_555 N O4 Ca4 Sr5 75.76030(20) 3_555 . 4_555 N O4 Ca4 Sr5 116.3403(10) 3_555 . 5_555 N O4 Ca4 Sr5 147.6226(11) 3_555 . 6_555 N O5 Ca4 O5 85.5917(7) -9_665 . -10_566 N O5 Ca4 O5 85.5917(11) -9_665 . -11_656 N O5 Ca4 Li2 51.6735(16) -9_665 . 9_556 N O5 Ca4 Li3 128.3264(16) -9_665 . 1_555 N O5 Ca4 Sr5 36.94800(10) -9_665 . 4_555 N O5 Ca4 Sr5 60.3767 -9_665 . 5_555 N O5 Ca4 Sr5 108.7298(4) -9_665 . 6_555 N O5 Ca4 O5 85.5917(18) -10_566 . -11_656 N O5 Ca4 Li2 51.6735(7) -10_566 . 9_556 N O5 Ca4 Li3 128.3264(7) -10_566 . 1_555 N O5 Ca4 Sr5 108.72980(10) -10_566 . 4_555 N O5 Ca4 Sr5 36.9480(10) -10_566 . 5_555 N O5 Ca4 Sr5 60.3767(11) -10_566 . 6_555 N O5 Ca4 Li2 51.6735(9) -11_656 . 9_556 N O5 Ca4 Li3 128.3264(9) -11_656 . 1_555 N O5 Ca4 Sr5 60.3767(11) -11_656 . 4_555 N O5 Ca4 Sr5 108.7298(4) -11_656 . 5_555 N O5 Ca4 Sr5 36.9480(11) -11_656 . 6_555 N Li2 Ca4 Li3 180.0 9_556 . 1_555 N Li2 Ca4 Sr5 58.4891(6) 9_556 . 4_555 N Li2 Ca4 Sr5 58.4891(6) 9_556 . 5_555 N Li2 Ca4 Sr5 58.4891(12) 9_556 . 6_555 N Li3 Ca4 Sr5 121.5109(6) 1_555 . 4_555 N Li3 Ca4 Sr5 121.5109(6) 1_555 . 5_555 N Li3 Ca4 Sr5 121.5109(12) 1_555 . 6_555 N Sr5 Ca4 Sr5 95.1773 4_555 . 5_555 N Sr5 Ca4 Sr5 95.17730(10) 4_555 . 6_555 N Sr5 Ca4 Sr5 95.17730(10) 5_555 . 6_555 N Ca2 Ca5 Ca3 179.0453 2_555 . 1_555 N Ca2 Ca5 Ca6 122.2378(7) 2_555 . 1_555 N Ca2 Ca5 Ca6 121.1947(12) 2_555 . 2_555 N Ca2 Ca5 Al1 68.4387(10) 2_555 . 2_555 N Ca2 Ca5 Al1 68.4821(10) 2_555 . -12_654 N Ca2 Ca5 Al2 104.5025(21) 2_555 . 1_555 N Ca2 Ca5 Al2 107.9003(10) 2_555 . 2_555 N Ca2 Ca5 Al2 102.8866(10) 2_555 . -9_564 N Ca2 Ca5 O1 86.85880(10) 2_555 . 2_555 N Ca2 Ca5 O2 89.86760(30) 2_555 . 2_555 N Ca2 Ca5 O3 134.3208(13) 2_555 . 1_555 N Ca2 Ca5 O5 46.8124(15) 2_555 . -6_566 N Ca2 Ca5 Li3 179.0453 2_555 . 1_555 N Ca2 Ca5 Sr4 49.8822(4) 2_555 . 4_455 N Ca2 Ca5 Sr5 55.2742(11) 2_555 . -7_565 N Ca2 Ca5 Sr5 55.2742(6) 2_555 . -9_665 N Ca3 Ca5 Ca6 58.0650(7) 1_555 . 1_555 N Ca3 Ca5 Ca6 57.8843(13) 1_555 . 2_555 N Ca3 Ca5 Al1 112.2145(10) 1_555 . 2_555 N Ca3 Ca5 Al1 111.7463(10) 1_555 . -12_654 N Ca3 Ca5 Al2 76.4454(22) 1_555 . 1_555 N Ca3 Ca5 Al2 71.9203(10) 1_555 . 2_555 N Ca3 Ca5 Al2 76.5053(10) 1_555 . -9_564 N Ca3 Ca5 O1 93.29920(10) 1_555 . 2_555 N Ca3 Ca5 O2 90.00800(30) 1_555 . 2_555 N Ca3 Ca5 O3 46.4870(13) 1_555 . 1_555 N Ca3 Ca5 O5 132.2787(15) 1_555 . -6_566 N Ca3 Ca5 Li3 0.0 1_555 . 1_555 N Ca3 Ca5 Sr4 129.8444(5) 1_555 . 4_455 N Ca3 Ca5 Sr5 125.6579(11) 1_555 . -7_565 N Ca3 Ca5 Sr5 124.0469(6) 1_555 . -9_665 N Ca6 Ca5 Ca6 96.9912 1_555 . 2_555 N Ca6 Ca5 Al1 124.8203(7) 1_555 . 2_555 N Ca6 Ca5 Al1 53.9046(4) 1_555 . -12_654 N Ca6 Ca5 Al2 61.37140(30) 1_555 . 1_555 N Ca6 Ca5 Al2 129.38609(30) 1_555 . 2_555 N Ca6 Ca5 Al2 56.1221(5) 1_555 . -9_564 N Ca6 Ca5 O1 140.9449 1_555 . 2_555 N Ca6 Ca5 O2 40.4539 1_555 . 2_555 N Ca6 Ca5 O3 32.7955 1_555 . 1_555 N Ca6 Ca5 O5 136.7893 1_555 . -6_566 N Ca6 Ca5 Li3 58.0650(7) 1_555 . 1_555 N Ca6 Ca5 Sr4 171.96460(20) 1_555 . 4_455 N Ca6 Ca5 Sr5 87.14400(20) 1_555 . -7_565 N Ca6 Ca5 Sr5 89.5275 1_555 . -9_665 N Ca6 Ca5 Al1 124.4571(11) 2_555 . 2_555 N Ca6 Ca5 Al1 125.3151(10) 2_555 . -12_654 N Ca6 Ca5 Al2 133.5934(9) 2_555 . 1_555 N Ca6 Ca5 Al2 58.8098(10) 2_555 . 2_555 N Ca6 Ca5 Al2 62.5259(9) 2_555 . -9_564 N Ca6 Ca5 O1 86.8452 2_555 . 2_555 N Ca6 Ca5 O2 96.62640(20) 2_555 . 2_555 N Ca6 Ca5 O3 102.85720(10) 2_555 . 1_555 N Ca6 Ca5 O5 74.42570(20) 2_555 . -6_566 N Ca6 Ca5 Li3 57.8843(13) 2_555 . 1_555 N Ca6 Ca5 Sr4 89.58340(30) 2_555 . 4_455 N Ca6 Ca5 Sr5 175.76390(20) 2_555 . -7_565 N Ca6 Ca5 Sr5 86.79300(10) 2_555 . -9_665 N Al1 Ca5 Al1 109.3912(21) 2_555 . -12_654 N Al1 Ca5 Al2 63.6106(10) 2_555 . 1_555 N Al1 Ca5 Al2 66.2074(20) 2_555 . 2_555 N Al1 Ca5 Al2 170.65010(10) 2_555 . -9_564 N Al1 Ca5 O1 37.6144(11) 2_555 . 2_555 N Al1 Ca5 O2 138.8647(13) 2_555 . 2_555 N Al1 Ca5 O3 97.5317(5) 2_555 . 1_555 N Al1 Ca5 O5 92.2469(5) 2_555 . -6_566 N Al1 Ca5 Li3 112.2145(10) 2_555 . 1_555 N Al1 Ca5 Sr4 53.3508(4) 2_555 . 4_455 N Al1 Ca5 Sr5 52.9543(10) 2_555 . -7_565 N Al1 Ca5 Sr5 123.6872(5) 2_555 . -9_665 N Al1 Ca5 Al2 76.8439(13) -12_564 . 1_555 N Al1 Ca5 Al2 175.38560(10) -12_564 . 2_555 N Al1 Ca5 Al2 62.9227(20) -12_564 . -9_564 N Al1 Ca5 O1 146.2243(9) -12_555 . 2_555 N Al1 Ca5 O2 29.9664(8) -12_665 . 2_555 N Al1 Ca5 O3 76.92670(20) -12_665 . 1_555 N Al1 Ca5 O5 96.2016(4) -12_665 . -6_566 N Al1 Ca5 Li3 111.7463(10) -12_665 . 1_555 N Al1 Ca5 Sr4 118.3292(6) -12_665 . 4_455 N Al1 Ca5 Sr5 56.7090(11) -12_665 . -7_565 N Al1 Ca5 Sr5 53.0468(6) -12_665 . -9_665 N Al2 Ca5 Al2 101.7478(12) 1_555 . 2_555 N Al2 Ca5 Al2 117.1936(8) 1_555 . -9_564 N Al2 Ca5 O1 88.07140(10) 1_555 . 2_555 N Al2 Ca5 O2 90.75130(30) 1_555 . 2_555 N Al2 Ca5 O3 36.9493(6) 1_555 . 1_555 N Al2 Ca5 O5 149.7528(6) 1_555 . -6_566 N Al2 Ca5 Li3 76.4454(22) 1_555 . 1_555 N Al2 Ca5 Sr4 116.7898(6) 1_555 . 4_455 N Al2 Ca5 Sr5 49.5174(11) 1_555 . -7_565 N Al2 Ca5 Sr5 129.5315(7) 1_555 . -9_665 N Al2 Ca5 Al2 121.3087(19) 2_555 . -9_564 N Al2 Ca5 O1 29.2009(9) 2_555 . 2_555 N Al2 Ca5 O2 154.5911(8) 2_555 . 2_555 N Al2 Ca5 O3 104.66490(20) 2_555 . 1_555 N Al2 Ca5 O5 82.8108(4) 2_555 . -6_566 N Al2 Ca5 Li3 71.9203(10) 2_555 . 1_555 N Al2 Ca5 Sr4 58.2261(5) 2_555 . 4_455 N Al2 Ca5 Sr5 119.0211(11) 2_555 . -7_565 N Al2 Ca5 Sr5 127.6881(5) 2_555 . -9_665 N Al2 Ca5 O1 148.6774(10) -9_555 . 2_555 N Al2 Ca5 O2 34.4528(11) -9_665 . 2_555 N Al2 Ca5 O3 86.09920(30) -9_665 . 1_555 N Al2 Ca5 O5 83.65540(30) -9_665 . -6_566 N Al2 Ca5 Li3 76.5053(10) -9_665 . 1_555 N Al2 Ca5 Sr4 124.15230(20) -9_665 . 4_455 N Al2 Ca5 Sr5 119.6314(9) -9_665 . -7_565 N Al2 Ca5 Sr5 47.8924(4) -9_665 . -9_665 N O1 Ca5 O2 176.12869(10) 2_555 . 2_555 N O1 Ca5 O3 108.4201 2_555 . 1_555 N O1 Ca5 O5 81.7455 2_555 . -6_566 N O1 Ca5 Li3 93.29920(10) 2_555 . 1_555 N O1 Ca5 Sr4 43.7241 2_555 . 4_455 N O1 Ca5 Sr5 90.52030(10) 2_555 . -7_565 N O1 Ca5 Sr5 129.5268 2_555 . -9_665 N O2 Ca5 O3 72.5365 2_555 . 1_555 N O2 Ca5 O5 97.50420(10) 2_555 . -6_566 N O2 Ca5 Li3 90.00800(30) 2_555 . 1_555 N O2 Ca5 Sr4 134.30490(10) 2_555 . 4_455 N O2 Ca5 Sr5 85.91360(30) 2_555 . -7_565 N O2 Ca5 Sr5 49.285 2_555 . -9_665 N O3 Ca5 O5 169.4805 1_555 . -6_566 N O3 Ca5 Li3 46.4870(13) 1_555 . 1_555 N O3 Ca5 Sr4 149.44820(20) 1_555 . 4_455 N O3 Ca5 Sr5 81.12190(30) 1_555 . -7_565 N O3 Ca5 Sr5 121.8069 1_555 . -9_665 N O5 Ca5 Li3 132.2787(15) -6_566 . 1_555 N O5 Ca5 Sr4 41.03230(20) -6_566 . 4_455 N O5 Ca5 Sr5 101.9213(4) -6_566 . -7_565 N O5 Ca5 Sr5 48.42780(10) -6_566 . -9_665 N Li3 Ca5 Sr4 129.8444(5) 1_555 . 4_455 N Li3 Ca5 Sr5 125.6579(11) 1_555 . -7_565 N Li3 Ca5 Sr5 124.0469(6) 1_555 . -9_665 N Sr4 Ca5 Sr5 86.22110(10) 4_455 . -7_565 N Sr4 Ca5 Sr5 86.2211 4_455 . -9_665 N Sr5 Ca5 Sr5 92.33980(10) -7_565 . -9_665 N Ca1 Ca6 Ca3 177.811 5_555 . 1_555 N Ca1 Ca6 Ca5 128.7518(4) 5_555 . 1_555 N Ca1 Ca6 Ca5 129.5734(4) 5_555 . 3_555 N Ca1 Ca6 Ca6 54.6079(11) 5_555 . 6_554 N Ca1 Ca6 Ca6 54.6080(5) 5_555 . -11_546 N Ca1 Ca6 Al1 72.4208(21) 5_555 . -9_654 N Ca1 Ca6 Al1 71.7208(10) 5_555 . -12_654 N Ca1 Ca6 Al2 107.6270(10) 5_555 . -9_564 N Ca1 Ca6 O1 96.8026(17) 5_555 . -9_555 N Ca1 Ca6 O2 96.41990(10) 5_555 . 2_555 N Ca1 Ca6 O3 140.0973(12) 5_555 . 1_555 N Ca1 Ca6 O4 133.0652(8) 5_555 . 3_555 N Ca1 Ca6 O6 44.7553(8) 5_555 . -5_665 N Ca1 Ca6 O6 44.7672(14) 5_555 . -9_665 N Ca1 Ca6 Li1 0.0 5_555 . 5_555 N Ca1 Ca6 Li3 177.811 5_555 . 1_555 N Ca1 Ca6 Sr4 126.9388(10) 5_555 . 1_555 N Ca1 Ca6 Sr5 128.7518(4) 5_555 . 1_555 N Ca1 Ca6 Sr5 129.5734(4) 5_555 . 3_555 N Ca1 Ca6 Ce5 128.7518(4) 5_555 . 1_555 N Ca1 Ca6 Ce5 129.5734(4) 5_555 . 3_555 N Ca3 Ca6 Ca5 52.0010(5) 1_555 . 1_555 N Ca3 Ca6 Ca5 51.8568(5) 1_555 . 3_555 N Ca3 Ca6 Ca6 127.5484(11) 1_555 . 6_554 N Ca3 Ca6 Ca6 124.6323(5) 1_555 . -11_546 N Ca3 Ca6 Al1 105.4043(22) 1_555 . -9_654 N Ca3 Ca6 Al1 108.8848(10) 1_555 . -12_654 N Ca3 Ca6 Al2 71.1000(10) 1_555 . -9_564 N Ca3 Ca6 O1 81.2198(17) 1_555 . -9_555 N Ca3 Ca6 O2 83.39560(10) 1_555 . 2_555 N Ca3 Ca6 O3 41.9404(12) 1_555 . 1_555 N Ca3 Ca6 O4 45.9410(9) 1_555 . 3_555 N Ca3 Ca6 O6 136.8572(8) 1_555 . -5_665 N Ca3 Ca6 O6 133.1540(14) 1_555 . -9_665 N Ca3 Ca6 Li1 177.811 1_555 . 5_555 N Ca3 Ca6 Li3 0.0 1_555 . 1_555 N Ca3 Ca6 Sr4 50.9067(11) 1_555 . 1_555 N Ca3 Ca6 Sr5 52.0010(5) 1_555 . 1_555 N Ca3 Ca6 Sr5 51.8568(5) 1_555 . 3_555 N Ca3 Ca6 Ce5 52.0010(5) 1_555 . 1_555 N Ca3 Ca6 Ce5 51.8568(5) 1_555 . 3_555 N Ca5 Ca6 Ca5 84.669 1_555 . 3_555 N Ca5 Ca6 Ca6 93.06130(10) 1_555 . 6_554 N Ca5 Ca6 Ca6 176.63240(10) 1_555 . -11_546 N Ca5 Ca6 Al1 120.9015(7) 1_555 . -9_654 N Ca5 Ca6 Al1 57.0952(6) 1_555 . -12_654 N Ca5 Ca6 Al2 52.09890(30) 1_555 . -9_564 N Ca5 Ca6 O1 81.0511 1_555 . -9_555 N Ca5 Ca6 O2 39.0553 1_555 . 2_555 N Ca5 Ca6 O3 35.931 1_555 . 1_555 N Ca5 Ca6 O4 97.8103(4) 1_555 . 3_555 N Ca5 Ca6 O6 130.8916(9) 1_555 . -5_665 N Ca5 Ca6 O6 141.42320(10) 1_555 . -9_665 N Ca5 Ca6 Li1 128.7518(4) 1_555 . 5_555 N Ca5 Ca6 Li3 52.0010(5) 1_555 . 1_555 N Ca5 Ca6 Sr4 85.94850(10) 1_555 . 1_555 N Ca5 Ca6 Sr5 0.0 1_555 . 1_555 N Ca5 Ca6 Sr5 84.669 1_555 . 3_555 N Ca5 Ca6 Ce5 0.0 1_555 . 1_555 N Ca5 Ca6 Ce5 84.669 1_555 . 3_555 N Ca5 Ca6 Ca6 92.96550(20) 3_555 . 6_554 N Ca5 Ca6 Ca6 92.978 3_555 . -11_546 N Ca5 Ca6 Al1 126.7516(8) 3_555 . -9_654 N Ca5 Ca6 Al1 127.11970(30) 3_555 . -12_654 N Ca5 Ca6 Al2 122.6609(6) 3_555 . -9_564 N Ca5 Ca6 O1 128.3695(12) 3_555 . -9_555 N Ca5 Ca6 O2 123.7113 3_555 . 2_555 N Ca5 Ca6 O3 49.9646 3_555 . 1_555 N Ca5 Ca6 O4 49.7887(8) 3_555 . 3_555 N Ca5 Ca6 O6 85.12830(30) 3_555 . -5_665 N Ca5 Ca6 O6 130.64590(10) 3_555 . -9_665 N Ca5 Ca6 Li1 129.5734(4) 3_555 . 5_555 N Ca5 Ca6 Li3 51.8568(5) 3_555 . 1_555 N Ca5 Ca6 Sr4 85.74480(10) 3_555 . 1_555 N Ca5 Ca6 Sr5 84.669 3_555 . 1_555 N Ca5 Ca6 Sr5 0.0 3_555 . 3_555 N Ca5 Ca6 Ce5 84.669 3_555 . 1_555 N Ca5 Ca6 Ce5 0.0 3_555 . 3_555 N Ca6 Ca6 Ca6 89.4613 6_554 . -11_546 N Ca6 Ca6 Al1 126.9412(10) 6_554 . -9_654 N Ca6 Ca6 Al1 58.4331(10) 6_554 . -12_654 N Ca6 Ca6 Al2 121.1054(10) 6_554 . -9_564 N Ca6 Ca6 O1 136.9400(11) 6_554 . -9_555 N Ca6 Ca6 O2 89.7975 6_554 . 2_555 N Ca6 Ca6 O3 86.15770(10) 6_554 . 1_555 N Ca6 Ca6 O4 139.4486(11) 6_554 . 3_555 N Ca6 Ca6 O6 39.8390(11) 6_554 . -5_665 N Ca6 Ca6 O6 98.98230(30) 6_554 . -9_665 N Ca6 Ca6 Li1 54.6079(11) 6_554 . 5_555 N Ca6 Ca6 Li3 127.5484(11) 6_554 . 1_555 N Ca6 Ca6 Sr4 178.43941(10) 6_554 . 1_555 N Ca6 Ca6 Sr5 93.06130(10) 6_554 . 1_555 N Ca6 Ca6 Sr5 92.96550(20) 6_554 . 3_555 N Ca6 Ca6 Ce5 93.06130(10) 6_554 . 1_555 N Ca6 Ca6 Ce5 92.96550(20) 6_554 . 3_555 N Ca6 Ca6 Al1 58.8264(5) -11_645 . -9_654 N Ca6 Ca6 Al1 126.2444(5) -11_645 . -12_654 N Ca6 Ca6 Al2 128.0385(4) -11_555 . -9_564 N Ca6 Ca6 O1 98.60820(10) -11_546 . -9_555 N Ca6 Ca6 O2 143.2886 -11_656 . 2_555 N Ca6 Ca6 O3 142.2542 -11_656 . 1_555 N Ca6 Ca6 O4 78.82500(30) -11_656 . 3_555 N Ca6 Ca6 O6 51.0766(10) -11_656 . -5_665 N Ca6 Ca6 O6 39.99420(10) -11_656 . -9_665 N Ca6 Ca6 Li1 54.6080(5) -11_656 . 5_555 N Ca6 Ca6 Li3 124.6323(5) -11_656 . 1_555 N Ca6 Ca6 Sr4 91.4817 -11_656 . 1_555 N Ca6 Ca6 Sr5 176.63240(10) -11_656 . 1_555 N Ca6 Ca6 Sr5 92.978 -11_656 . 3_555 N Ca6 Ca6 Ce5 176.63240(10) -11_656 . 1_555 N Ca6 Ca6 Ce5 92.978 -11_656 . 3_555 N Al1 Ca6 Al1 105.0031(11) -9_654 . -12_654 N Al1 Ca6 Al2 69.3478(9) -9_564 . -9_564 N Al1 Ca6 O1 39.8505(6) -9_555 . -9_555 N Al1 Ca6 O2 93.4744 -9_665 . 2_555 N Al1 Ca6 O3 145.2340(9) -9_665 . 1_555 N Al1 Ca6 O4 79.1468(17) -9_665 . 3_555 N Al1 Ca6 O6 103.3747(16) -9_665 . -5_665 N Al1 Ca6 O6 29.4189(7) -9_665 . -9_665 N Al1 Ca6 Li1 72.4208(21) -9_665 . 5_555 N Al1 Ca6 Li3 105.4043(22) -9_665 . 1_555 N Al1 Ca6 Sr4 54.6162(11) -9_665 . 1_555 N Al1 Ca6 Sr5 120.9015(7) -9_665 . 1_555 N Al1 Ca6 Sr5 126.7516(8) -9_665 . 3_555 N Al1 Ca6 Ce5 120.9015(7) -9_665 . 1_555 N Al1 Ca6 Ce5 126.7516(8) -9_665 . 3_555 N Al1 Ca6 Al2 62.6819(20) -12_564 . -9_564 N Al1 Ca6 O1 83.7385(19) -12_555 . -9_555 N Al1 Ca6 O2 32.4740(10) -12_665 . 2_555 N Al1 Ca6 O3 82.1236 -12_665 . 1_555 N Al1 Ca6 O4 153.37109(20) -12_665 . 3_555 N Al1 Ca6 O6 93.6639(20) -12_665 . -5_665 N Al1 Ca6 O6 99.26430(20) -12_665 . -9_665 N Al1 Ca6 Li1 71.7208(10) -12_665 . 5_555 N Al1 Ca6 Li3 108.8848(10) -12_665 . 1_555 N Al1 Ca6 Sr4 121.7822(10) -12_665 . 1_555 N Al1 Ca6 Sr5 57.0952(6) -12_665 . 1_555 N Al1 Ca6 Sr5 127.11970(30) -12_665 . 3_555 N Al1 Ca6 Ce5 57.0952(6) -12_665 . 1_555 N Al1 Ca6 Ce5 127.11970(30) -12_665 . 3_555 N Al2 Ca6 O1 30.11700(30) -9_555 . -9_555 N Al2 Ca6 O2 32.1560(10) -9_665 . 2_555 N Al2 Ca6 O3 85.12550(20) -9_665 . 1_555 N Al2 Ca6 O4 95.7945(20) -9_665 . 3_555 N Al2 Ca6 O6 150.51970(20) -9_665 . -5_665 N Al2 Ca6 O6 90.91690(30) -9_665 . -9_665 N Al2 Ca6 Li1 107.6270(10) -9_665 . 5_555 N Al2 Ca6 Li3 71.1000(10) -9_665 . 1_555 N Al2 Ca6 Sr4 59.1041(10) -9_665 . 1_555 N Al2 Ca6 Sr5 52.09890(30) -9_665 . 1_555 N Al2 Ca6 Sr5 122.6609(6) -9_665 . 3_555 N Al2 Ca6 Ce5 52.09890(30) -9_665 . 1_555 N Al2 Ca6 Ce5 122.6609(6) -9_665 . 3_555 N O1 Ca6 O2 59.2719(7) -9_665 . 2_555 N O1 Ca6 O3 109.97550(20) -9_665 . 1_555 N O1 Ca6 O4 83.4743(22) -9_665 . 3_555 N O1 Ca6 O6 138.9874(9) -9_665 . -5_665 N O1 Ca6 O6 65.1988 -9_665 . -9_665 N O1 Ca6 Li1 96.8026(17) -9_665 . 5_555 N O1 Ca6 Li3 81.2198(17) -9_665 . 1_555 N O1 Ca6 Sr4 44.0911(11) -9_665 . 1_555 N O1 Ca6 Sr5 81.0511 -9_665 . 1_555 N O1 Ca6 Sr5 128.3695(12) -9_665 . 3_555 N O1 Ca6 Ce5 81.0511 -9_665 . 1_555 N O1 Ca6 Ce5 128.3695(12) -9_665 . 3_555 N O2 Ca6 O3 74.2429 2_555 . 1_555 N O2 Ca6 O4 122.2314(8) 2_555 . 3_555 N O2 Ca6 O6 126.0921(10) 2_555 . -5_665 N O2 Ca6 O6 104.1488 2_555 . -9_665 N O2 Ca6 Li1 96.41990(10) 2_555 . 5_555 N O2 Ca6 Li3 83.39560(10) 2_555 . 1_555 N O2 Ca6 Sr4 90.1892 2_555 . 1_555 N O2 Ca6 Sr5 39.0553 2_555 . 1_555 N O2 Ca6 Sr5 123.7113 2_555 . 3_555 N O2 Ca6 Ce5 39.0553 2_555 . 1_555 N O2 Ca6 Ce5 123.7113 2_555 . 3_555 N O3 Ca6 O4 80.4604(4) 1_555 . 3_555 N O3 Ca6 O6 110.1610(7) 1_555 . -5_665 N O3 Ca6 O6 174.65289(20) 1_555 . -9_665 N O3 Ca6 Li1 140.0973(12) 1_555 . 5_555 N O3 Ca6 Li3 41.9404(12) 1_555 . 1_555 N O3 Ca6 Sr4 92.33690(20) 1_555 . 1_555 N O3 Ca6 Sr5 35.931 1_555 . 1_555 N O3 Ca6 Sr5 49.9646 1_555 . 3_555 N O3 Ca6 Ce5 35.931 1_555 . 1_555 N O3 Ca6 Ce5 49.9646 1_555 . 3_555 N O4 Ca6 O6 111.1938(18) 3_555 . -5_665 N O4 Ca6 O6 96.3987(7) 3_555 . -9_665 N O4 Ca6 Li1 133.0652(8) 3_555 . 5_555 N O4 Ca6 Li3 45.9410(9) 3_555 . 1_555 N O4 Ca6 Sr4 39.6777(11) 3_555 . 1_555 N O4 Ca6 Sr5 97.8103(4) 3_555 . 1_555 N O4 Ca6 Sr5 49.7887(8) 3_555 . 3_555 N O4 Ca6 Ce5 97.8103(4) 3_555 . 1_555 N O4 Ca6 Ce5 49.7887(8) 3_555 . 3_555 N O6 Ca6 O6 74.9740(9) -5_665 . -9_665 N O6 Ca6 Li1 44.7553(8) -5_665 . 5_555 N O6 Ca6 Li3 136.8572(8) -5_665 . 1_555 N O6 Ca6 Sr4 140.7488(11) -5_665 . 1_555 N O6 Ca6 Sr5 130.8916(9) -5_665 . 1_555 N O6 Ca6 Sr5 85.12830(30) -5_665 . 3_555 N O6 Ca6 Ce5 130.8916(9) -5_665 . 1_555 N O6 Ca6 Ce5 85.12830(30) -5_665 . 3_555 N O6 Ca6 Li1 44.7672(14) -9_665 . 5_555 N O6 Ca6 Li3 133.1540(14) -9_665 . 1_555 N O6 Ca6 Sr4 82.5333(4) -9_665 . 1_555 N O6 Ca6 Sr5 141.42320(10) -9_665 . 1_555 N O6 Ca6 Sr5 130.64590(10) -9_665 . 3_555 N O6 Ca6 Ce5 141.42320(10) -9_665 . 1_555 N O6 Ca6 Ce5 130.64590(10) -9_665 . 3_555 N Li1 Ca6 Li3 177.811 5_555 . 1_555 N Li1 Ca6 Sr4 126.9388(10) 5_555 . 1_555 N Li1 Ca6 Sr5 128.7518(4) 5_555 . 1_555 N Li1 Ca6 Sr5 129.5734(4) 5_555 . 3_555 N Li1 Ca6 Ce5 128.7518(4) 5_555 . 1_555 N Li1 Ca6 Ce5 129.5734(4) 5_555 . 3_555 N Li3 Ca6 Sr4 50.9067(11) 1_555 . 1_555 N Li3 Ca6 Sr5 52.0010(5) 1_555 . 1_555 N Li3 Ca6 Sr5 51.8568(5) 1_555 . 3_555 N Li3 Ca6 Ce5 52.0010(5) 1_555 . 1_555 N Li3 Ca6 Ce5 51.8568(5) 1_555 . 3_555 N Sr4 Ca6 Sr5 85.94850(10) 1_555 . 1_555 N Sr4 Ca6 Sr5 85.74480(10) 1_555 . 3_555 N Sr4 Ca6 Ce5 85.94850(10) 1_555 . 1_555 N Sr4 Ca6 Ce5 85.74480(10) 1_555 . 3_555 N Sr5 Ca6 Sr5 84.669 1_555 . 3_555 N Sr5 Ca6 Ce5 0.0 1_555 . 1_555 N Sr5 Ca6 Ce5 84.669 1_555 . 3_555 N Sr5 Ca6 Ce5 84.669 3_555 . 1_555 N Sr5 Ca6 Ce5 0.0 3_555 . 3_555 N Ce5 Ca6 Ce5 84.669 1_555 . 3_555 N Ca4 Al1 Ca5 72.4376(21) 6_554 . 3_555 N Ca4 Al1 Ca5 109.7037(11) 6_554 . -12_554 N Ca4 Al1 Ca6 74.1680(12) 6_554 . -7_455 N Ca4 Al1 Ca6 173.738 6_554 . -12_545 N Ca4 Al1 O1 55.1251(4) 6_554 . 1_555 N Ca4 Al1 O2 134.3874(8) 6_554 . 5_545 N Ca4 Al1 O5 51.2080(4) 6_554 . 1_555 N Ca4 Al1 O6 117.6082(14) 6_554 . 1_555 N Ca4 Al1 Sr4 0.0 6_554 . 6_554 N Ca4 Al1 Sr5 72.4376(21) 6_554 . 3_555 N Ca4 Al1 Sr5 109.7037(11) 6_554 . -12_655 N Ca5 Al1 Ca5 73.9989(11) 3_555 . -12_554 N Ca5 Al1 Ca6 113.0535(11) 3_555 . -7_455 N Ca5 Al1 Ca6 112.4554(21) 3_555 . -12_545 N Ca5 Al1 O1 55.5014(7) 3_555 . 1_555 N Ca5 Al1 O2 65.3223(15) 3_555 . 5_545 N Ca5 Al1 O5 82.5401(11) 3_555 . 1_555 N Ca5 Al1 O6 140.11 3_555 . 1_555 N Ca5 Al1 Sr4 72.4376(21) 3_555 . 6_554 N Ca5 Al1 Sr5 0.0 3_555 . 3_555 N Ca5 Al1 Sr5 73.9989(11) 3_555 . -12_655 N Ca5 Al1 Ca6 172.90410(10) -12_545 . -7_455 N Ca5 Al1 Ca6 69.0003(9) -12_545 . -12_545 N Ca5 Al1 O1 129.3982(4) -12_545 . 1_555 N Ca5 Al1 O2 42.9205(6) -12_655 . 5_545 N Ca5 Al1 O5 64.6689(16) -12_655 . 1_555 N Ca5 Al1 O6 127.67170(20) -12_655 . 1_555 N Ca5 Al1 Sr4 109.7037(11) -12_655 . 6_554 N Ca5 Al1 Sr5 73.9989(11) -12_655 . 3_555 N Ca5 Al1 Sr5 0.0 -12_655 . -12_655 N Ca6 Al1 Ca6 106.4785(11) -7_455 . -12_545 N Ca6 Al1 O1 57.6909(4) -7_455 . 1_555 N Ca6 Al1 O2 138.2140(7) -7_565 . 5_545 N Ca6 Al1 O5 115.9879(17) -7_565 . 1_555 N Ca6 Al1 O6 46.41040(10) -7_565 . 1_555 N Ca6 Al1 Sr4 74.1680(12) -7_565 . 6_554 N Ca6 Al1 Sr5 113.0535(11) -7_565 . 3_555 N Ca6 Al1 Sr5 172.90410(10) -7_565 . -12_655 N Ca6 Al1 O1 130.6503(4) -12_545 . 1_555 N Ca6 Al1 O2 48.9213(7) -12_655 . 5_545 N Ca6 Al1 O5 124.4245(4) -12_655 . 1_555 N Ca6 Al1 O6 61.4784(12) -12_655 . 1_555 N Ca6 Al1 Sr4 173.738 -12_655 . 6_554 N Ca6 Al1 Sr5 112.4554(21) -12_655 . 3_555 N Ca6 Al1 Sr5 69.0003(9) -12_655 . -12_655 N O1 Al1 O2 108.8440(4) 1_555 . 5_545 N O1 Al1 O5 102.59960(20) 1_555 . 1_555 N O1 Al1 O6 96.67580(10) 1_555 . 1_555 N O1 Al1 Sr4 55.1251(4) 1_555 . 6_554 N O1 Al1 Sr5 55.5014(7) 1_555 . 3_555 N O1 Al1 Sr5 129.3982(4) 1_555 . -12_655 N O2 Al1 O5 105.3672(10) 5_545 . 1_555 N O2 Al1 O6 105.8619(7) 5_545 . 1_555 N O2 Al1 Sr4 134.3874(8) 5_545 . 6_554 N O2 Al1 Sr5 65.3223(15) 5_545 . 3_555 N O2 Al1 Sr5 42.9205(6) 5_545 . -12_655 N O5 Al1 O6 135.2756(12) 1_555 . 1_555 N O5 Al1 Sr4 51.2080(4) 1_555 . 6_554 N O5 Al1 Sr5 82.5401(11) 1_555 . 3_555 N O5 Al1 Sr5 64.6689(16) 1_555 . -12_655 N O6 Al1 Sr4 117.6082(14) 1_555 . 6_554 N O6 Al1 Sr5 140.11 1_555 . 3_555 N O6 Al1 Sr5 127.67170(20) 1_555 . -12_655 N Sr4 Al1 Sr5 72.4376(21) 6_554 . 3_555 N Sr4 Al1 Sr5 109.7037(11) 6_554 . -12_655 N Sr5 Al1 Sr5 73.9989(11) 3_555 . -12_655 N Ca5 Al2 Ca5 104.3252(21) 1_555 . 3_555 N Ca5 Al2 Ca5 82.5901(22) 1_555 . -7_464 N Ca5 Al2 Ca6 121.2419(10) 1_555 . -7_455 N Ca5 Al2 O1 137.6936(7) 1_555 . 1_555 N Ca5 Al2 O2 74.7555(11) 1_555 . 6_554 N Ca5 Al2 O3 50.9538(11) 1_555 . 1_555 N Ca5 Al2 O4 130.4015(10) 1_555 . -7_565 N Ca5 Al2 Sr5 0.0 1_555 . 1_555 N Ca5 Al2 Sr5 104.3252(21) 1_555 . 3_555 N Ca5 Al2 Sr5 82.5901(22) 1_555 . -7_565 N Ca5 Al2 Ce5 0.0 1_555 . 1_555 N Ca5 Al2 Ce5 82.5901(22) 1_555 . -7_565 N Ca5 Al2 Ca5 168.27299(10) 3_555 . -7_464 N Ca5 Al2 Ca6 111.1907(11) 3_555 . -7_455 N Ca5 Al2 O1 55.5628(8) 3_555 . 1_555 N Ca5 Al2 O2 140.4028 3_555 . 6_554 N Ca5 Al2 O3 59.2222(12) 3_555 . 1_555 N Ca5 Al2 O4 103.1008(17) 3_555 . -7_565 N Ca5 Al2 Sr5 104.3252(21) 3_555 . 1_555 N Ca5 Al2 Sr5 0.0 3_555 . 3_555 N Ca5 Al2 Sr5 168.27299(10) 3_555 . -7_565 N Ca5 Al2 Ce5 104.3252(21) 3_555 . 1_555 N Ca5 Al2 Ce5 168.27299(10) 3_555 . -7_565 N Ca5 Al2 Ca6 71.7790(13) -7_455 . -7_455 N Ca5 Al2 O1 124.8872(11) -7_455 . 1_555 N Ca5 Al2 O2 50.17060(10) -7_565 . 6_554 N Ca5 Al2 O3 122.1915(14) -7_565 . 1_555 N Ca5 Al2 O4 65.4992(16) -7_565 . -7_565 N Ca5 Al2 Sr5 82.5901(22) -7_565 . 1_555 N Ca5 Al2 Sr5 168.27299(10) -7_565 . 3_555 N Ca5 Al2 Sr5 0.0 -7_565 . -7_565 N Ca5 Al2 Ce5 82.5901(22) -7_565 . 1_555 N Ca5 Al2 Ce5 0.0 -7_565 . -7_565 N Ca6 Al2 O1 55.95120(30) -7_455 . 1_555 N Ca6 Al2 O2 48.07300(10) -7_565 . 6_554 N Ca6 Al2 O3 157.24260(10) -7_565 . 1_555 N Ca6 Al2 O4 84.7768(20) -7_565 . -7_565 N Ca6 Al2 Sr5 121.2419(10) -7_565 . 1_555 N Ca6 Al2 Sr5 111.1907(11) -7_565 . 3_555 N Ca6 Al2 Sr5 71.7790(13) -7_565 . -7_565 N Ca6 Al2 Ce5 121.2419(10) -7_565 . 1_555 N Ca6 Al2 Ce5 71.7790(13) -7_565 . -7_565 N O1 Al2 O2 97.86450(10) 1_555 . 6_554 N O1 Al2 O3 112.9080(4) 1_555 . 1_555 N O1 Al2 O4 91.8232(4) 1_555 . -7_565 N O1 Al2 Sr5 137.6936(7) 1_555 . 1_555 N O1 Al2 Sr5 55.5628(8) 1_555 . 3_555 N O1 Al2 Sr5 124.8872(11) 1_555 . -7_565 N O1 Al2 Ce5 137.6936(7) 1_555 . 1_555 N O1 Al2 Ce5 124.8872(11) 1_555 . -7_565 N O2 Al2 O3 124.25710(10) 6_554 . 1_555 N O2 Al2 O4 106.8565(16) 6_554 . -7_565 N O2 Al2 Sr5 74.7555(11) 6_554 . 1_555 N O2 Al2 Sr5 140.4028 6_554 . 3_555 N O2 Al2 Sr5 50.17060(10) 6_554 . -7_565 N O2 Al2 Ce5 74.7555(11) 6_554 . 1_555 N O2 Al2 Ce5 50.17060(10) 6_554 . -7_565 N O3 Al2 O4 116.8174(19) 1_555 . -7_565 N O3 Al2 Sr5 50.9538(11) 1_555 . 1_555 N O3 Al2 Sr5 59.2222(12) 1_555 . 3_555 N O3 Al2 Sr5 122.1915(14) 1_555 . -7_565 N O3 Al2 Ce5 50.9538(11) 1_555 . 1_555 N O3 Al2 Ce5 122.1915(14) 1_555 . -7_565 N O4 Al2 Sr5 130.4015(10) -7_565 . 1_555 N O4 Al2 Sr5 103.1008(17) -7_565 . 3_555 N O4 Al2 Sr5 65.4992(16) -7_565 . -7_565 N O4 Al2 Ce5 130.4015(10) -7_565 . 1_555 N O4 Al2 Ce5 65.4992(16) -7_565 . -7_565 N Sr5 Al2 Sr5 104.3252(21) 1_555 . 3_555 N Sr5 Al2 Sr5 82.5901(22) 1_555 . -7_565 N Sr5 Al2 Ce5 0.0 1_555 . 1_555 N Sr5 Al2 Ce5 82.5901(22) 1_555 . -7_565 N Sr5 Al2 Sr5 168.27299(10) 3_555 . -7_565 N Sr5 Al2 Ce5 104.3252(21) 3_555 . 1_555 N Sr5 Al2 Ce5 168.27299(10) 3_555 . -7_565 N Sr5 Al2 Ce5 82.5901(22) -7_565 . 1_555 N Sr5 Al2 Ce5 0.0 -7_565 . -7_565 N Ce5 Al2 Ce5 82.5901(22) 1_555 . -7_565 N Ca4 O1 Ca5 91.6928(22) 6_554 . 3_555 N Ca4 O1 Ca6 92.2598(22) 6_554 . -7_455 N Ca4 O1 Al1 86.77520(20) 6_554 . 1_555 N Ca4 O1 Al2 107.76300(10) 6_554 . 1_555 N Ca4 O1 Sr4 0.0 6_554 . 6_554 N Ca4 O1 Sr5 91.6928(22) 6_554 . 3_555 N Ca5 O1 Ca6 168.40240(20) 3_555 . -7_455 N Ca5 O1 Al1 86.88420(10) 3_555 . 1_555 N Ca5 O1 Al2 95.2363(4) 3_555 . 1_555 N Ca5 O1 Sr4 91.6928(22) 3_555 . 6_554 N Ca5 O1 Sr5 0.0 3_555 . 3_555 N Ca6 O1 Al1 82.45860(30) -7_554 . 1_555 N Ca6 O1 Al2 93.93180(20) -7_464 . 1_555 N Ca6 O1 Sr4 92.2598(22) -7_565 . 6_554 N Ca6 O1 Sr5 168.40240(20) -7_565 . 3_555 N Al1 O1 Al2 165.19960(20) 1_555 . 1_555 N Al1 O1 Sr4 86.77520(20) 1_555 . 6_554 N Al1 O1 Sr5 86.88420(10) 1_555 . 3_555 N Al2 O1 Sr4 107.76300(10) 1_555 . 6_554 N Al2 O1 Sr5 95.2363(4) 1_555 . 3_555 N Sr4 O1 Sr5 91.6928(22) 6_554 . 3_555 N Ca5 O2 Ca6 100.4909(22) 3_555 . 3_555 N Ca5 O2 Al1 107.11310(30) 3_555 . -8_645 N Ca5 O2 Al2 95.37660(10) 3_555 . -11_555 N Ca5 O2 Sr5 0.0 3_555 . 3_555 N Ca5 O2 Ce5 0.0 3_555 . 3_555 N Ca6 O2 Al1 98.60470(30) 3_555 . -8_645 N Ca6 O2 Al2 99.77100(20) 3_555 . -11_555 N Ca6 O2 Sr5 100.4909(22) 3_555 . 3_555 N Ca6 O2 Ce5 100.4909(22) 3_555 . 3_555 N Al1 O2 Al2 147.6851 -8_555 . -11_555 N Al1 O2 Sr5 107.11310(30) -8_656 . 3_555 N Al1 O2 Ce5 107.11310(30) -8_656 . 3_555 N Al2 O2 Sr5 95.37660(10) -11_656 . 3_555 N Al2 O2 Ce5 95.37660(10) -11_656 . 3_555 N Sr5 O2 Ce5 0.0 3_555 . 3_555 N Ca3 O3 Ca5 85.1067(4) 1_555 . 1_555 N Ca3 O3 Ca6 98.5518(6) 1_555 . 1_555 N Ca3 O3 Al2 136.4339(15) 1_555 . 1_555 N Ca3 O3 Li3 0.0 1_555 . 1_555 N Ca3 O3 Sr5 85.1067(4) 1_555 . 1_555 N Ca3 O3 Sr5 73.71590(10) 1_555 . 3_555 N Ca3 O3 Ce5 85.1067(4) 1_555 . 1_555 N Ca5 O3 Ca6 111.27350(10) 1_555 . 1_555 N Ca5 O3 Al2 92.0968(5) 1_555 . 1_555 N Ca5 O3 Li3 85.1067(4) 1_555 . 1_555 N Ca5 O3 Sr5 0.0 1_555 . 1_555 N Ca5 O3 Sr5 148.66100(30) 1_555 . 3_555 N Ca5 O3 Ce5 0.0 1_555 . 1_555 N Ca6 O3 Al2 122.5313(8) 1_555 . 1_555 N Ca6 O3 Li3 98.5518(6) 1_555 . 1_555 N Ca6 O3 Sr5 111.27350(10) 1_555 . 1_555 N Ca6 O3 Sr5 94.804 1_555 . 3_555 N Ca6 O3 Ce5 111.27350(10) 1_555 . 1_555 N Al2 O3 Li3 136.4339(15) 1_555 . 1_555 N Al2 O3 Sr5 92.0968(5) 1_555 . 1_555 N Al2 O3 Sr5 87.9025(6) 1_555 . 3_555 N Al2 O3 Ce5 92.0968(5) 1_555 . 1_555 N Li3 O3 Sr5 85.1067(4) 1_555 . 1_555 N Li3 O3 Sr5 73.71590(10) 1_555 . 3_555 N Li3 O3 Ce5 85.1067(4) 1_555 . 1_555 N Sr5 O3 Sr5 148.66100(30) 1_555 . 3_555 N Sr5 O3 Ce5 0.0 1_555 . 1_555 N Sr5 O3 Ce5 148.66100(30) 3_555 . 1_555 N Ca3 O4 Ca4 76.6605(7) 1_555 . 1_555 N Ca3 O4 Ca6 96.0901(6) 1_555 . 2_555 N Ca3 O4 Al2 126.7673(14) 1_555 . -9_564 N Ca3 O4 Sr4 76.6605(7) 1_555 . 1_555 N Ca3 O4 Ce4 76.6605(7) 1_555 . 1_555 N Ca3 O4 Sr5 71.5889(4) 1_555 . 1_555 N Ca4 O4 Ca6 110.4196(18) 1_555 . 2_555 N Ca4 O4 Al2 103.0248(9) 1_555 . -9_564 N Ca4 O4 Sr4 0.0 1_555 . 1_555 N Ca4 O4 Ce4 0.0 1_555 . 1_555 N Ca4 O4 Sr5 140.05730(20) 1_555 . 1_555 N Ca6 O4 Al2 130.7164(7) 2_555 . -9_564 N Ca6 O4 Sr4 110.4196(18) 2_555 . 1_555 N Ca6 O4 Ce4 110.4196(18) 2_555 . 1_555 N Ca6 O4 Sr5 96.6356(21) 2_555 . 1_555 N Al2 O4 Sr4 103.0248(9) -9_665 . 1_555 N Al2 O4 Ce4 103.0248(9) -9_665 . 1_555 N Al2 O4 Sr5 78.3160(17) -9_665 . 1_555 N Sr4 O4 Ce4 0.0 1_555 . 1_555 N Sr4 O4 Sr5 140.05730(20) 1_555 . 1_555 N Ce4 O4 Sr5 140.05730(20) 1_555 . 1_555 N Ca2 O5 Ca4 74.8212(6) 1_555 . 6_554 N Ca2 O5 Ca5 90.0210(5) 1_555 . 11_554 N Ca2 O5 Al1 141.0688(9) 1_555 . 1_555 N Ca2 O5 Sr4 74.8212(6) 1_555 . 6_554 N Ca2 O5 Ce4 74.8212(6) 1_555 . 6_554 N Ca2 O5 Sr5 90.0210(5) 1_555 . 11_554 N Ca2 O5 Ce5 90.0210(5) 1_555 . 11_554 N Ca4 O5 Ca5 102.0197(19) 6_554 . 11_554 N Ca4 O5 Al1 102.2529(7) 6_554 . 1_555 N Ca4 O5 Sr4 0.0 6_554 . 6_554 N Ca4 O5 Ce4 0.0 6_554 . 6_554 N Ca4 O5 Sr5 102.0197(19) 6_554 . 11_554 N Ca4 O5 Ce5 102.0197(19) 6_554 . 11_554 N Ca5 O5 Al1 127.6865(4) 11_554 . 1_555 N Ca5 O5 Sr4 102.0197(19) 11_554 . 6_554 N Ca5 O5 Ce4 102.0197(19) 11_554 . 6_554 N Ca5 O5 Sr5 0.0 11_554 . 11_554 N Ca5 O5 Ce5 0.0 11_554 . 11_554 N Al1 O5 Sr4 102.2529(7) 1_555 . 6_554 N Al1 O5 Ce4 102.2529(7) 1_555 . 6_554 N Al1 O5 Sr5 127.6865(4) 1_555 . 11_554 N Al1 O5 Ce5 127.6865(4) 1_555 . 11_554 N Sr4 O5 Ce4 0.0 6_554 . 6_554 N Sr4 O5 Sr5 102.0197(19) 6_554 . 11_554 N Sr4 O5 Ce5 102.0197(19) 6_554 . 11_554 N Ce4 O5 Sr5 102.0197(19) 6_554 . 11_554 N Ce4 O5 Ce5 102.0197(19) 6_554 . 11_554 N Sr5 O5 Ce5 0.0 11_554 . 11_554 N Ca1 O6 Ca6 86.2433(5) 1_555 . 8_554 N Ca1 O6 Ca6 86.4304(5) 1_555 . -7_455 N Ca1 O6 Al1 154.2083(9) 1_555 . 1_555 N Ca1 O6 Li1 0.0 1_555 . 1_555 N Ca6 O6 Ca6 100.1667(21) 8_554 . -7_455 N Ca6 O6 Al1 114.1608(4) 8_554 . 1_555 N Ca6 O6 Li1 86.2433(5) 8_554 . 1_555 N Ca6 O6 Al1 104.1708(6) -7_554 . 1_555 N Ca6 O6 Li1 86.4304(5) -7_565 . 1_555 N Al1 O6 Li1 154.2083(9) 1_555 . 1_555 N Ca6 Li1 Ca6 109.2159(10) 7_545 . 8_554 N Ca6 Li1 Ca6 109.2159(11) 7_545 . 12_455 N Ca6 Li1 Ca6 180.0 7_545 . -7_455 N Ca6 Li1 Ca6 70.7841(10) 7_545 . -8_446 N Ca6 Li1 Ca6 70.7841(11) 7_545 . -12_545 N Ca6 Li1 O6 131.19749(20) 7_545 . 1_555 N Ca6 Li1 O6 119.0362(4) 7_545 . 2_555 N Ca6 Li1 O6 49.0014(8) 7_545 . 3_555 N Ca6 Li1 O6 48.80250(20) 7_545 . -1_555 N Ca6 Li1 O6 60.9638(4) 7_545 . -2_555 N Ca6 Li1 O6 130.9986(8) 7_545 . -3_555 N Ca6 Li1 Ca6 109.2159(21) 8_554 . 12_455 N Ca6 Li1 Ca6 70.7841(10) 8_554 . -7_455 N Ca6 Li1 Ca6 180.0 8_554 . -8_446 N Ca6 Li1 Ca6 70.7841(21) 8_554 . -12_545 N Ca6 Li1 O6 49.00140(20) 8_554 . 1_555 N Ca6 Li1 O6 131.1975(7) 8_554 . 2_555 N Ca6 Li1 O6 119.0362(13) 8_554 . 3_555 N Ca6 Li1 O6 130.99860(20) 8_554 . -1_555 N Ca6 Li1 O6 48.8025(7) 8_554 . -2_555 N Ca6 Li1 O6 60.9638(13) 8_554 . -3_555 N Ca6 Li1 Ca6 70.7841(11) 12_455 . -7_455 N Ca6 Li1 Ca6 70.7841(21) 12_455 . -8_446 N Ca6 Li1 Ca6 180.0 12_455 . -12_545 N Ca6 Li1 O6 119.0362(9) 12_455 . 1_555 N Ca6 Li1 O6 49.0014(6) 12_455 . 2_555 N Ca6 Li1 O6 131.1975(9) 12_455 . 3_555 N Ca6 Li1 O6 60.9638(9) 12_455 . -1_555 N Ca6 Li1 O6 130.9986(6) 12_455 . -2_555 N Ca6 Li1 O6 48.8025(9) 12_455 . -3_555 N Ca6 Li1 Ca6 109.2159(10) -7_455 . -8_446 N Ca6 Li1 Ca6 109.2159(11) -7_455 . -12_545 N Ca6 Li1 O6 48.80250(20) -7_565 . 1_555 N Ca6 Li1 O6 60.9638(4) -7_565 . 2_555 N Ca6 Li1 O6 130.9986(8) -7_565 . 3_555 N Ca6 Li1 O6 131.19749(20) -7_565 . -1_555 N Ca6 Li1 O6 119.0362(4) -7_565 . -2_555 N Ca6 Li1 O6 49.0014(8) -7_565 . -3_555 N Ca6 Li1 Ca6 109.2159(21) -8_446 . -12_545 N Ca6 Li1 O6 130.99860(20) -8_556 . 1_555 N Ca6 Li1 O6 48.8025(7) -8_556 . 2_555 N Ca6 Li1 O6 60.9638(13) -8_556 . 3_555 N Ca6 Li1 O6 49.00140(20) -8_556 . -1_555 N Ca6 Li1 O6 131.1975(7) -8_556 . -2_555 N Ca6 Li1 O6 119.0362(13) -8_556 . -3_555 N Ca6 Li1 O6 60.9638(9) -12_655 . 1_555 N Ca6 Li1 O6 130.9986(6) -12_655 . 2_555 N Ca6 Li1 O6 48.8025(9) -12_655 . 3_555 N Ca6 Li1 O6 119.0362(9) -12_655 . -1_555 N Ca6 Li1 O6 49.0014(6) -12_655 . -2_555 N Ca6 Li1 O6 131.1975(9) -12_655 . -3_555 N O6 Li1 O6 98.7199 1_555 . 2_555 N O6 Li1 O6 98.71990(30) 1_555 . 3_555 N O6 Li1 O6 180.0 1_555 . -1_555 N O6 Li1 O6 81.2801 1_555 . -2_555 N O6 Li1 O6 81.28010(30) 1_555 . -3_555 N O6 Li1 O6 98.71990(30) 2_555 . 3_555 N O6 Li1 O6 81.2801 2_555 . -1_555 N O6 Li1 O6 180.0 2_555 . -2_555 N O6 Li1 O6 81.28010(30) 2_555 . -3_555 N O6 Li1 O6 81.28010(30) 3_555 . -1_555 N O6 Li1 O6 81.28010(30) 3_555 . -2_555 N O6 Li1 O6 180.0 3_555 . -3_555 N O6 Li1 O6 98.7199 -1_555 . -2_555 N O6 Li1 O6 98.71990(30) -1_555 . -3_555 N O6 Li1 O6 98.71990(30) -2_555 . -3_555 N Ca4 Li2 Ca4 180.0 6_554 . 7_645 N Ca4 Li2 Sr4 0.0 6_554 . 6_554 N Ca4 Li2 Sr4 180.0 6_554 . 7_645 N Ca4 Li2 Ce4 0.0 6_554 . 6_554 N Ca4 Li2 Ce4 180.0 6_554 . 7_645 N Ca4 Li2 Sr5 71.6286(21) 6_554 . 3_555 N Ca4 Li2 Sr5 71.6287(10) 6_554 . 11_554 N Ca4 Li2 Sr5 71.6286(11) 6_554 . 12_555 N Ca4 Li2 Sr5 108.3714(21) 6_554 . -3_655 N Ca4 Li2 Sr5 108.3714(10) 6_554 . -11_656 N Ca4 Li2 Sr5 108.3714(11) 6_554 . -12_655 N Ca4 Li2 Sr4 180.0 7_645 . 6_554 N Ca4 Li2 Sr4 0.0 7_645 . 7_645 N Ca4 Li2 Ce4 180.0 7_645 . 6_554 N Ca4 Li2 Ce4 0.0 7_645 . 7_645 N Ca4 Li2 Sr5 108.3713(21) 7_645 . 3_555 N Ca4 Li2 Sr5 108.3714(10) 7_645 . 11_554 N Ca4 Li2 Sr5 108.3714(11) 7_645 . 12_555 N Ca4 Li2 Sr5 71.6286(21) 7_645 . -3_655 N Ca4 Li2 Sr5 71.6286(10) 7_645 . -11_656 N Ca4 Li2 Sr5 71.6286(11) 7_645 . -12_655 N Sr4 Li2 Sr4 180.0 6_554 . 7_645 N Sr4 Li2 Ce4 0.0 6_554 . 6_554 N Sr4 Li2 Ce4 180.0 6_554 . 7_645 N Sr4 Li2 Sr5 71.6286(21) 6_554 . 3_555 N Sr4 Li2 Sr5 71.6287(10) 6_554 . 11_554 N Sr4 Li2 Sr5 71.6286(11) 6_554 . 12_555 N Sr4 Li2 Sr5 108.3714(21) 6_554 . -3_655 N Sr4 Li2 Sr5 108.3714(10) 6_554 . -11_656 N Sr4 Li2 Sr5 108.3714(11) 6_554 . -12_655 N Sr4 Li2 Ce4 180.0 7_645 . 6_554 N Sr4 Li2 Ce4 0.0 7_645 . 7_645 N Sr4 Li2 Sr5 108.3713(21) 7_645 . 3_555 N Sr4 Li2 Sr5 108.3714(10) 7_645 . 11_554 N Sr4 Li2 Sr5 108.3714(11) 7_645 . 12_555 N Sr4 Li2 Sr5 71.6286(21) 7_645 . -3_655 N Sr4 Li2 Sr5 71.6286(10) 7_645 . -11_656 N Sr4 Li2 Sr5 71.6286(11) 7_645 . -12_655 N Ce4 Li2 Ce4 180.0 6_554 . 7_645 N Ce4 Li2 Sr5 71.6286(21) 6_554 . 3_555 N Ce4 Li2 Sr5 71.6287(10) 6_554 . 11_554 N Ce4 Li2 Sr5 71.6286(11) 6_554 . 12_555 N Ce4 Li2 Sr5 108.3714(21) 6_554 . -3_655 N Ce4 Li2 Sr5 108.3714(10) 6_554 . -11_656 N Ce4 Li2 Sr5 108.3714(11) 6_554 . -12_655 N Ce4 Li2 Sr5 108.3713(21) 7_645 . 3_555 N Ce4 Li2 Sr5 108.3714(10) 7_645 . 11_554 N Ce4 Li2 Sr5 108.3714(11) 7_645 . 12_555 N Ce4 Li2 Sr5 71.6286(21) 7_645 . -3_655 N Ce4 Li2 Sr5 71.6286(10) 7_645 . -11_656 N Ce4 Li2 Sr5 71.6286(11) 7_645 . -12_655 N Sr5 Li2 Sr5 110.5483(10) 3_555 . 11_554 N Sr5 Li2 Sr5 110.5483(11) 3_555 . 12_555 N Sr5 Li2 Sr5 180.0 3_555 . -3_655 N Sr5 Li2 Sr5 69.4517(10) 3_555 . -11_656 N Sr5 Li2 Sr5 69.4517(11) 3_555 . -12_655 N Sr5 Li2 Sr5 110.5483(21) 11_554 . 12_555 N Sr5 Li2 Sr5 69.4517(10) 11_554 . -3_655 N Sr5 Li2 Sr5 180.0 11_554 . -11_656 N Sr5 Li2 Sr5 69.4517(21) 11_554 . -12_655 N Sr5 Li2 Sr5 69.4517(11) 12_555 . -3_655 N Sr5 Li2 Sr5 69.4517(21) 12_555 . -11_656 N Sr5 Li2 Sr5 180.0 12_555 . -12_655 N Sr5 Li2 Sr5 110.5483(10) -3_655 . -11_656 N Sr5 Li2 Sr5 110.5483(11) -3_655 . -12_655 N Sr5 Li2 Sr5 110.5483(21) -11_656 . -12_655 N Ca4 Li3 Ca5 111.7519(11) 1_555 . 1_555 N Ca4 Li3 Ca5 111.7519(21) 1_555 . 2_555 N Ca4 Li3 Ca5 111.7519(10) 1_555 . 3_555 N Ca4 Li3 Ca6 73.5491(22) 1_555 . 1_555 N Ca4 Li3 Ca6 73.5491(11) 1_555 . 2_555 N Ca4 Li3 Ca6 73.5491(11) 1_555 . 3_555 N Ca4 Li3 O3 112.4069(15) 1_555 . 1_555 N Ca4 Li3 O3 112.4069(10) 1_555 . 2_555 N Ca4 Li3 O3 112.4069(5) 1_555 . 3_555 N Ca4 Li3 Sr4 0.0 1_555 . 1_555 N Ca4 Li3 Ce4 0.0 1_555 . 1_555 N Ca4 Li3 Sr5 111.7519(11) 1_555 . 1_555 N Ca4 Li3 Sr5 111.7519(21) 1_555 . 2_555 N Ca4 Li3 Sr5 111.7519(10) 1_555 . 3_555 N Ca4 Li3 Ce5 111.7519(11) 1_555 . 1_555 N Ca4 Li3 Ce5 111.7519(21) 1_555 . 2_555 N Ca4 Li3 Ce5 111.7519(10) 1_555 . 3_555 N Ca5 Li3 Ca5 107.0974(11) 1_555 . 2_555 N Ca5 Li3 Ca5 107.0974(21) 1_555 . 3_555 N Ca5 Li3 Ca6 69.9340(12) 1_555 . 1_555 N Ca5 Li3 Ca6 70.2589(21) 1_555 . 2_555 N Ca5 Li3 Ca6 174.6957 1_555 . 3_555 N Ca5 Li3 O3 48.4064(9) 1_555 . 1_555 N Ca5 Li3 O3 61.9637(12) 1_555 . 2_555 N Ca5 Li3 O3 135.2422(5) 1_555 . 3_555 N Ca5 Li3 Sr4 111.7519(11) 1_555 . 1_555 N Ca5 Li3 Ce4 111.7519(11) 1_555 . 1_555 N Ca5 Li3 Sr5 0.0 1_555 . 1_555 N Ca5 Li3 Sr5 107.0974(11) 1_555 . 2_555 N Ca5 Li3 Sr5 107.0974(21) 1_555 . 3_555 N Ca5 Li3 Ce5 0.0 1_555 . 1_555 N Ca5 Li3 Ce5 107.0974(11) 1_555 . 2_555 N Ca5 Li3 Ce5 107.0974(21) 1_555 . 3_555 N Ca5 Li3 Ca5 107.0974(11) 2_555 . 3_555 N Ca5 Li3 Ca6 174.69569(10) 2_555 . 1_555 N Ca5 Li3 Ca6 69.9340(9) 2_555 . 2_555 N Ca5 Li3 Ca6 70.2589(10) 2_555 . 3_555 N Ca5 Li3 O3 135.2422(6) 2_555 . 1_555 N Ca5 Li3 O3 48.40640(10) 2_555 . 2_555 N Ca5 Li3 O3 61.96370(20) 2_555 . 3_555 N Ca5 Li3 Sr4 111.7519(21) 2_555 . 1_555 N Ca5 Li3 Ce4 111.7519(21) 2_555 . 1_555 N Ca5 Li3 Sr5 107.0974(11) 2_555 . 1_555 N Ca5 Li3 Sr5 0.0 2_555 . 2_555 N Ca5 Li3 Sr5 107.0974(11) 2_555 . 3_555 N Ca5 Li3 Ce5 107.0974(11) 2_555 . 1_555 N Ca5 Li3 Ce5 0.0 2_555 . 2_555 N Ca5 Li3 Ce5 107.0974(11) 2_555 . 3_555 N Ca5 Li3 Ca6 70.2589(12) 3_555 . 1_555 N Ca5 Li3 Ca6 174.6957 3_555 . 2_555 N Ca5 Li3 Ca6 69.9340(21) 3_555 . 3_555 N Ca5 Li3 O3 61.9637(14) 3_555 . 1_555 N Ca5 Li3 O3 135.2422 3_555 . 2_555 N Ca5 Li3 O3 48.4064(10) 3_555 . 3_555 N Ca5 Li3 Sr4 111.7519(10) 3_555 . 1_555 N Ca5 Li3 Ce4 111.7519(10) 3_555 . 1_555 N Ca5 Li3 Sr5 107.0974(21) 3_555 . 1_555 N Ca5 Li3 Sr5 107.0974(11) 3_555 . 2_555 N Ca5 Li3 Sr5 0.0 3_555 . 3_555 N Ca5 Li3 Ce5 107.0974(21) 3_555 . 1_555 N Ca5 Li3 Ce5 107.0974(11) 3_555 . 2_555 N Ca5 Li3 Ce5 0.0 3_555 . 3_555 N Ca6 Li3 Ca6 112.3153(10) 1_555 . 2_555 N Ca6 Li3 Ca6 112.3153(10) 1_555 . 3_555 N Ca6 Li3 O3 39.5077(6) 1_555 . 1_555 N Ca6 Li3 O3 130.175 1_555 . 2_555 N Ca6 Li3 O3 116.76030(20) 1_555 . 3_555 N Ca6 Li3 Sr4 73.5491(22) 1_555 . 1_555 N Ca6 Li3 Ce4 73.5491(22) 1_555 . 1_555 N Ca6 Li3 Sr5 69.9340(12) 1_555 . 1_555 N Ca6 Li3 Sr5 174.69569(10) 1_555 . 2_555 N Ca6 Li3 Sr5 70.2589(12) 1_555 . 3_555 N Ca6 Li3 Ce5 69.9340(12) 1_555 . 1_555 N Ca6 Li3 Ce5 174.69569(10) 1_555 . 2_555 N Ca6 Li3 Ce5 70.2589(12) 1_555 . 3_555 N Ca6 Li3 Ca6 112.3153(21) 2_555 . 3_555 N Ca6 Li3 O3 116.7603(13) 2_555 . 1_555 N Ca6 Li3 O3 39.50770(10) 2_555 . 2_555 N Ca6 Li3 O3 130.1750(8) 2_555 . 3_555 N Ca6 Li3 Sr4 73.5491(11) 2_555 . 1_555 N Ca6 Li3 Ce4 73.5491(11) 2_555 . 1_555 N Ca6 Li3 Sr5 70.2589(21) 2_555 . 1_555 N Ca6 Li3 Sr5 69.9340(9) 2_555 . 2_555 N Ca6 Li3 Sr5 174.6957 2_555 . 3_555 N Ca6 Li3 Ce5 70.2589(21) 2_555 . 1_555 N Ca6 Li3 Ce5 69.9340(9) 2_555 . 2_555 N Ca6 Li3 Ce5 174.6957 2_555 . 3_555 N Ca6 Li3 O3 130.1750(8) 3_555 . 1_555 N Ca6 Li3 O3 116.7603(11) 3_555 . 2_555 N Ca6 Li3 O3 39.5077(6) 3_555 . 3_555 N Ca6 Li3 Sr4 73.5491(11) 3_555 . 1_555 N Ca6 Li3 Ce4 73.5491(11) 3_555 . 1_555 N Ca6 Li3 Sr5 174.6957 3_555 . 1_555 N Ca6 Li3 Sr5 70.2589(10) 3_555 . 2_555 N Ca6 Li3 Sr5 69.9340(21) 3_555 . 3_555 N Ca6 Li3 Ce5 174.6957 3_555 . 1_555 N Ca6 Li3 Ce5 70.2589(10) 3_555 . 2_555 N Ca6 Li3 Ce5 69.9340(21) 3_555 . 3_555 N O3 Li3 O3 106.3826(4) 1_555 . 2_555 N O3 Li3 O3 106.38260(30) 1_555 . 3_555 N O3 Li3 Sr4 112.4069(15) 1_555 . 1_555 N O3 Li3 Ce4 112.4069(15) 1_555 . 1_555 N O3 Li3 Sr5 48.4064(9) 1_555 . 1_555 N O3 Li3 Sr5 135.2422(6) 1_555 . 2_555 N O3 Li3 Sr5 61.9637(14) 1_555 . 3_555 N O3 Li3 Ce5 48.4064(9) 1_555 . 1_555 N O3 Li3 Ce5 135.2422(6) 1_555 . 2_555 N O3 Li3 Ce5 61.9637(14) 1_555 . 3_555 N O3 Li3 O3 106.38260(10) 2_555 . 3_555 N O3 Li3 Sr4 112.4069(10) 2_555 . 1_555 N O3 Li3 Ce4 112.4069(10) 2_555 . 1_555 N O3 Li3 Sr5 61.9637(12) 2_555 . 1_555 N O3 Li3 Sr5 48.40640(10) 2_555 . 2_555 N O3 Li3 Sr5 135.2422 2_555 . 3_555 N O3 Li3 Ce5 61.9637(12) 2_555 . 1_555 N O3 Li3 Ce5 48.40640(10) 2_555 . 2_555 N O3 Li3 Ce5 135.2422 2_555 . 3_555 N O3 Li3 Sr4 112.4069(5) 3_555 . 1_555 N O3 Li3 Ce4 112.4069(5) 3_555 . 1_555 N O3 Li3 Sr5 135.2422(5) 3_555 . 1_555 N O3 Li3 Sr5 61.96370(20) 3_555 . 2_555 N O3 Li3 Sr5 48.4064(10) 3_555 . 3_555 N O3 Li3 Ce5 135.2422(5) 3_555 . 1_555 N O3 Li3 Ce5 61.96370(20) 3_555 . 2_555 N O3 Li3 Ce5 48.4064(10) 3_555 . 3_555 N Sr4 Li3 Ce4 0.0 1_555 . 1_555 N Sr4 Li3 Sr5 111.7519(11) 1_555 . 1_555 N Sr4 Li3 Sr5 111.7519(21) 1_555 . 2_555 N Sr4 Li3 Sr5 111.7519(10) 1_555 . 3_555 N Sr4 Li3 Ce5 111.7519(11) 1_555 . 1_555 N Sr4 Li3 Ce5 111.7519(21) 1_555 . 2_555 N Sr4 Li3 Ce5 111.7519(10) 1_555 . 3_555 N Ce4 Li3 Sr5 111.7519(11) 1_555 . 1_555 N Ce4 Li3 Sr5 111.7519(21) 1_555 . 2_555 N Ce4 Li3 Sr5 111.7519(10) 1_555 . 3_555 N Ce4 Li3 Ce5 111.7519(11) 1_555 . 1_555 N Ce4 Li3 Ce5 111.7519(21) 1_555 . 2_555 N Ce4 Li3 Ce5 111.7519(10) 1_555 . 3_555 N Sr5 Li3 Sr5 107.0974(11) 1_555 . 2_555 N Sr5 Li3 Sr5 107.0974(21) 1_555 . 3_555 N Sr5 Li3 Ce5 0.0 1_555 . 1_555 N Sr5 Li3 Ce5 107.0974(11) 1_555 . 2_555 N Sr5 Li3 Ce5 107.0974(21) 1_555 . 3_555 N Sr5 Li3 Sr5 107.0974(11) 2_555 . 3_555 N Sr5 Li3 Ce5 107.0974(11) 2_555 . 1_555 N Sr5 Li3 Ce5 0.0 2_555 . 2_555 N Sr5 Li3 Ce5 107.0974(11) 2_555 . 3_555 N Sr5 Li3 Ce5 107.0974(21) 3_555 . 1_555 N Sr5 Li3 Ce5 107.0974(11) 3_555 . 2_555 N Sr5 Li3 Ce5 0.0 3_555 . 3_555 N Ce5 Li3 Ce5 107.0974(11) 1_555 . 2_555 N Ce5 Li3 Ce5 107.0974(21) 1_555 . 3_555 N Ce5 Li3 Ce5 107.0974(11) 2_555 . 3_555 N Ca2 Sr4 Ca3 180.0 9_556 . 1_555 N Ca2 Sr4 Ca5 58.4891(6) 9_556 . 4_555 N Ca2 Sr4 Ca5 58.4891(6) 9_556 . 5_555 N Ca2 Sr4 Ca5 58.4891(12) 9_556 . 6_555 N Ca2 Sr4 Ca6 124.4558(11) 9_556 . 1_555 N Ca2 Sr4 Ca6 124.4558(5) 9_556 . 2_555 N Ca2 Sr4 Ca6 124.4558(6) 9_556 . 3_555 N Ca2 Sr4 Al1 73.3611(21) 9_556 . -9_654 N Ca2 Sr4 Al1 73.3611(12) 9_556 . -10_555 N Ca2 Sr4 Al1 73.3611(10) 9_556 . -11_645 N Ca2 Sr4 O1 95.3318(17) 9_556 . -9_555 N Ca2 Sr4 O1 95.3318(19) 9_556 . -10_456 N Ca2 Sr4 O1 95.33180(30) 9_556 . -11_546 N Ca2 Sr4 O4 131.6605(5) 9_556 . 1_555 N Ca2 Sr4 O4 131.6605(14) 9_556 . 2_555 N Ca2 Sr4 O4 131.6605(8) 9_556 . 3_555 N Ca2 Sr4 O5 51.6735(16) 9_556 . -9_665 N Ca2 Sr4 O5 51.6735(7) 9_556 . -10_566 N Ca2 Sr4 O5 51.6735(9) 9_556 . -11_656 N Ca2 Sr4 Li2 0.0 9_556 . 9_556 N Ca2 Sr4 Li3 180.0 9_556 . 1_555 N Ca2 Sr4 Sr5 58.4891(6) 9_556 . 4_555 N Ca2 Sr4 Sr5 58.4891(6) 9_556 . 5_555 N Ca2 Sr4 Sr5 58.4891(12) 9_556 . 6_555 N Ca3 Sr4 Ca5 121.5109(6) 1_555 . 4_555 N Ca3 Sr4 Ca5 121.5109(6) 1_555 . 5_555 N Ca3 Sr4 Ca5 121.5109(12) 1_555 . 6_555 N Ca3 Sr4 Ca6 55.5442(11) 1_555 . 1_555 N Ca3 Sr4 Ca6 55.5442(5) 1_555 . 2_555 N Ca3 Sr4 Ca6 55.5442(6) 1_555 . 3_555 N Ca3 Sr4 Al1 106.6389(21) 1_555 . -9_654 N Ca3 Sr4 Al1 106.6389(12) 1_555 . -10_555 N Ca3 Sr4 Al1 106.6389(10) 1_555 . -11_645 N Ca3 Sr4 O1 84.6682(17) 1_555 . -9_555 N Ca3 Sr4 O1 84.6682(19) 1_555 . -10_456 N Ca3 Sr4 O1 84.66820(30) 1_555 . -11_546 N Ca3 Sr4 O4 48.3395(5) 1_555 . 1_555 N Ca3 Sr4 O4 48.3395(14) 1_555 . 2_555 N Ca3 Sr4 O4 48.3395(8) 1_555 . 3_555 N Ca3 Sr4 O5 128.3264(16) 1_555 . -9_665 N Ca3 Sr4 O5 128.3264(7) 1_555 . -10_566 N Ca3 Sr4 O5 128.3264(9) 1_555 . -11_656 N Ca3 Sr4 Li2 180.0 1_555 . 9_556 N Ca3 Sr4 Li3 0.0 1_555 . 1_555 N Ca3 Sr4 Sr5 121.5109(6) 1_555 . 4_555 N Ca3 Sr4 Sr5 121.5109(6) 1_555 . 5_555 N Ca3 Sr4 Sr5 121.5109(12) 1_555 . 6_555 N Ca5 Sr4 Ca5 95.1773 4_555 . 5_555 N Ca5 Sr4 Ca5 95.17730(10) 4_555 . 6_555 N Ca5 Sr4 Ca6 85.88730(10) 4_555 . 1_555 N Ca5 Sr4 Ca6 176.79379(10) 4_555 . 2_555 N Ca5 Sr4 Ca6 87.7306 4_555 . 3_555 N Ca5 Sr4 Al1 57.94250(30) 4_555 . -9_654 N Ca5 Sr4 Al1 131.8044(5) 4_555 . -10_555 N Ca5 Sr4 Al1 54.2115(6) 4_555 . -11_645 N Ca5 Sr4 O1 95.90810(30) 4_555 . -9_555 N Ca5 Sr4 O1 139.0257(9) 4_555 . -10_456 N Ca5 Sr4 O1 44.5831 4_555 . -11_546 N Ca5 Sr4 O4 147.6226(10) 4_555 . 1_555 N Ca5 Sr4 O4 116.3403 4_555 . 2_555 N Ca5 Sr4 O4 75.76030(20) 4_555 . 3_555 N Ca5 Sr4 O5 36.94800(10) 4_555 . -9_665 N Ca5 Sr4 O5 108.72980(10) 4_555 . -10_566 N Ca5 Sr4 O5 60.3767(11) 4_555 . -11_656 N Ca5 Sr4 Li2 58.4891(6) 4_555 . 9_556 N Ca5 Sr4 Li3 121.5109(6) 4_555 . 1_555 N Ca5 Sr4 Sr5 0.0 4_555 . 4_555 N Ca5 Sr4 Sr5 95.1773 4_555 . 5_555 N Ca5 Sr4 Sr5 95.17730(10) 4_555 . 6_555 N Ca5 Sr4 Ca5 95.17730(10) 5_555 . 6_555 N Ca5 Sr4 Ca6 87.73060(10) 5_555 . 1_555 N Ca5 Sr4 Ca6 85.8873 5_555 . 2_555 N Ca5 Sr4 Ca6 176.7938 5_555 . 3_555 N Ca5 Sr4 Al1 54.2115(5) 5_555 . -9_654 N Ca5 Sr4 Al1 57.9425(6) 5_555 . -10_555 N Ca5 Sr4 Al1 131.8044(4) 5_555 . -11_645 N Ca5 Sr4 O1 44.5831(10) 5_555 . -9_555 N Ca5 Sr4 O1 95.9081 5_555 . -10_456 N Ca5 Sr4 O1 139.02570(10) 5_555 . -11_546 N Ca5 Sr4 O4 75.76030(10) 5_555 . 1_555 N Ca5 Sr4 O4 147.62260(10) 5_555 . 2_555 N Ca5 Sr4 O4 116.3403(10) 5_555 . 3_555 N Ca5 Sr4 O5 60.3767 5_555 . -9_665 N Ca5 Sr4 O5 36.9480(10) 5_555 . -10_566 N Ca5 Sr4 O5 108.7298(4) 5_555 . -11_656 N Ca5 Sr4 Li2 58.4891(6) 5_555 . 9_556 N Ca5 Sr4 Li3 121.5109(6) 5_555 . 1_555 N Ca5 Sr4 Sr5 95.1773 5_555 . 4_555 N Ca5 Sr4 Sr5 0.0 5_555 . 5_555 N Ca5 Sr4 Sr5 95.17730(10) 5_555 . 6_555 N Ca5 Sr4 Ca6 176.79379(10) 6_555 . 1_555 N Ca5 Sr4 Ca6 87.73060(10) 6_555 . 2_555 N Ca5 Sr4 Ca6 85.88730(10) 6_555 . 3_555 N Ca5 Sr4 Al1 131.8044(9) 6_555 . -9_654 N Ca5 Sr4 Al1 54.2115(11) 6_555 . -10_555 N Ca5 Sr4 Al1 57.9425(9) 6_555 . -11_645 N Ca5 Sr4 O1 139.0257(10) 6_555 . -9_555 N Ca5 Sr4 O1 44.5831(10) 6_555 . -10_456 N Ca5 Sr4 O1 95.90810(30) 6_555 . -11_546 N Ca5 Sr4 O4 116.3403(10) 6_555 . 1_555 N Ca5 Sr4 O4 75.76030(20) 6_555 . 2_555 N Ca5 Sr4 O4 147.6226(11) 6_555 . 3_555 N Ca5 Sr4 O5 108.7298(4) 6_555 . -9_665 N Ca5 Sr4 O5 60.3767(11) 6_555 . -10_566 N Ca5 Sr4 O5 36.9480(11) 6_555 . -11_656 N Ca5 Sr4 Li2 58.4891(12) 6_555 . 9_556 N Ca5 Sr4 Li3 121.5109(12) 6_555 . 1_555 N Ca5 Sr4 Sr5 95.17730(10) 6_555 . 4_555 N Ca5 Sr4 Sr5 95.17730(10) 6_555 . 5_555 N Ca5 Sr4 Sr5 0.0 6_555 . 6_555 N Ca6 Sr4 Ca6 91.1377 1_555 . 2_555 N Ca6 Sr4 Ca6 91.1377 1_555 . 3_555 N Ca6 Sr4 Al1 51.2159(11) 1_555 . -9_654 N Ca6 Sr4 Al1 126.8950(11) 1_555 . -10_555 N Ca6 Sr4 Al1 120.8001(10) 1_555 . -11_645 N Ca6 Sr4 O1 43.6491(11) 1_555 . -9_555 N Ca6 Sr4 O1 133.8370(11) 1_555 . -10_456 N Ca6 Sr4 O1 82.71820(30) 1_555 . -11_546 N Ca6 Sr4 O4 63.0572(9) 1_555 . 1_555 N Ca6 Sr4 O4 101.0546(4) 1_555 . 2_555 N Ca6 Sr4 O4 29.9027(10) 1_555 . 3_555 N Ca6 Sr4 O5 73.8906(5) 1_555 . -9_665 N Ca6 Sr4 O5 122.1333(10) 1_555 . -10_566 N Ca6 Sr4 O5 142.9541(11) 1_555 . -11_656 N Ca6 Sr4 Li2 124.4558(11) 1_555 . 9_556 N Ca6 Sr4 Li3 55.5442(11) 1_555 . 1_555 N Ca6 Sr4 Sr5 85.88730(10) 1_555 . 4_555 N Ca6 Sr4 Sr5 87.73060(10) 1_555 . 5_555 N Ca6 Sr4 Sr5 176.79379(10) 1_555 . 6_555 N Ca6 Sr4 Ca6 91.1377 2_555 . 3_555 N Ca6 Sr4 Al1 120.8001(5) 2_555 . -9_654 N Ca6 Sr4 Al1 51.2159(6) 2_555 . -10_555 N Ca6 Sr4 Al1 126.8950(5) 2_555 . -11_645 N Ca6 Sr4 O1 82.71820(20) 2_555 . -9_555 N Ca6 Sr4 O1 43.6491(11) 2_555 . -10_456 N Ca6 Sr4 O1 133.837 2_555 . -11_546 N Ca6 Sr4 O4 29.9027(9) 2_555 . 1_555 N Ca6 Sr4 O4 63.0572 2_555 . 2_555 N Ca6 Sr4 O4 101.05460(30) 2_555 . 3_555 N Ca6 Sr4 O5 142.95410(20) 2_555 . -9_665 N Ca6 Sr4 O5 73.89060(20) 2_555 . -10_566 N Ca6 Sr4 O5 122.1333(9) 2_555 . -11_656 N Ca6 Sr4 Li2 124.4558(5) 2_555 . 9_556 N Ca6 Sr4 Li3 55.5442(5) 2_555 . 1_555 N Ca6 Sr4 Sr5 176.79379(10) 2_555 . 4_555 N Ca6 Sr4 Sr5 85.8873 2_555 . 5_555 N Ca6 Sr4 Sr5 87.73060(10) 2_555 . 6_555 N Ca6 Sr4 Al1 126.8950(6) 3_555 . -9_654 N Ca6 Sr4 Al1 120.8001(5) 3_555 . -10_555 N Ca6 Sr4 Al1 51.2159(4) 3_555 . -11_645 N Ca6 Sr4 O1 133.8370(11) 3_555 . -9_555 N Ca6 Sr4 O1 82.71820(10) 3_555 . -10_456 N Ca6 Sr4 O1 43.6491 3_555 . -11_546 N Ca6 Sr4 O4 101.05460(10) 3_555 . 1_555 N Ca6 Sr4 O4 29.90270(10) 3_555 . 2_555 N Ca6 Sr4 O4 63.0572(9) 3_555 . 3_555 N Ca6 Sr4 O5 122.13330(10) 3_555 . -9_665 N Ca6 Sr4 O5 142.9541(9) 3_555 . -10_566 N Ca6 Sr4 O5 73.8906(4) 3_555 . -11_656 N Ca6 Sr4 Li2 124.4558(6) 3_555 . 9_556 N Ca6 Sr4 Li3 55.5442(6) 3_555 . 1_555 N Ca6 Sr4 Sr5 87.7306 3_555 . 4_555 N Ca6 Sr4 Sr5 176.7938 3_555 . 5_555 N Ca6 Sr4 Sr5 85.88730(10) 3_555 . 6_555 N Al1 Sr4 Al1 112.1489(11) -9_654 . -10_555 N Al1 Sr4 Al1 112.1489(9) -9_654 . -11_645 N Al1 Sr4 O1 38.0997(7) -9_555 . -9_555 N Al1 Sr4 O1 149.8661(5) -9_555 . -10_456 N Al1 Sr4 O1 90.10930(30) -9_555 . -11_546 N Al1 Sr4 O4 93.1637(14) -9_665 . 1_555 N Al1 Sr4 O4 150.0741(6) -9_665 . 2_555 N Al1 Sr4 O4 69.4603(16) -9_665 . 3_555 N Al1 Sr4 O5 26.5391(4) -9_665 . -9_665 N Al1 Sr4 O5 89.1853(15) -9_665 . -10_566 N Al1 Sr4 O5 112.0946(15) -9_665 . -11_656 N Al1 Sr4 Li2 73.3611(21) -9_665 . 9_556 N Al1 Sr4 Li3 106.6389(21) -9_665 . 1_555 N Al1 Sr4 Sr5 57.94250(30) -9_665 . 4_555 N Al1 Sr4 Sr5 54.2115(5) -9_665 . 5_555 N Al1 Sr4 Sr5 131.8044(9) -9_665 . 6_555 N Al1 Sr4 Al1 112.1489(21) -10_555 . -11_645 N Al1 Sr4 O1 90.1093(19) -10_456 . -9_555 N Al1 Sr4 O1 38.0997(6) -10_456 . -10_456 N Al1 Sr4 O1 149.8661(8) -10_456 . -11_546 N Al1 Sr4 O4 69.4603(18) -10_566 . 1_555 N Al1 Sr4 O4 93.1637(5) -10_566 . 2_555 N Al1 Sr4 O4 150.07410(30) -10_566 . 3_555 N Al1 Sr4 O5 112.0946(4) -10_566 . -9_665 N Al1 Sr4 O5 26.53910(30) -10_566 . -10_566 N Al1 Sr4 O5 89.1853(21) -10_566 . -11_656 N Al1 Sr4 Li2 73.3611(12) -10_566 . 9_556 N Al1 Sr4 Li3 106.6389(12) -10_566 . 1_555 N Al1 Sr4 Sr5 131.8044(5) -10_566 . 4_555 N Al1 Sr4 Sr5 57.9425(6) -10_566 . 5_555 N Al1 Sr4 Sr5 54.2115(11) -10_566 . 6_555 N Al1 Sr4 O1 149.86610(30) -11_546 . -9_555 N Al1 Sr4 O1 90.1093(16) -11_546 . -10_456 N Al1 Sr4 O1 38.0997(13) -11_546 . -11_546 N Al1 Sr4 O4 150.07410(30) -11_656 . 1_555 N Al1 Sr4 O4 69.46030(20) -11_656 . 2_555 N Al1 Sr4 O4 93.1637(19) -11_656 . 3_555 N Al1 Sr4 O5 89.1853(6) -11_656 . -9_665 N Al1 Sr4 O5 112.0946(18) -11_656 . -10_566 N Al1 Sr4 O5 26.53910(10) -11_656 . -11_656 N Al1 Sr4 Li2 73.3611(10) -11_656 . 9_556 N Al1 Sr4 Li3 106.6389(10) -11_656 . 1_555 N Al1 Sr4 Sr5 54.2115(6) -11_656 . 4_555 N Al1 Sr4 Sr5 131.8044(4) -11_656 . 5_555 N Al1 Sr4 Sr5 57.9425(9) -11_656 . 6_555 N O1 Sr4 O1 119.1467(13) -9_555 . -10_456 N O1 Sr4 O1 119.1467(11) -9_555 . -11_546 N O1 Sr4 O4 55.7340(7) -9_665 . 1_555 N O1 Sr4 O4 131.66980(30) -9_665 . 2_555 N O1 Sr4 O4 73.3153(21) -9_665 . 3_555 N O1 Sr4 O5 62.90150(30) -9_665 . -9_665 N O1 Sr4 O5 78.7090(21) -9_665 . -10_566 N O1 Sr4 O5 145.5067(8) -9_665 . -11_656 N O1 Sr4 Li2 95.3318(17) -9_665 . 9_556 N O1 Sr4 Li3 84.6682(17) -9_665 . 1_555 N O1 Sr4 Sr5 95.90810(30) -9_665 . 4_555 N O1 Sr4 Sr5 44.5831(10) -9_665 . 5_555 N O1 Sr4 Sr5 139.0257(10) -9_665 . 6_555 N O1 Sr4 O1 119.14670(20) -10_456 . -11_546 N O1 Sr4 O4 73.3153(19) -10_566 . 1_555 N O1 Sr4 O4 55.73400(10) -10_566 . 2_555 N O1 Sr4 O4 131.6698(11) -10_566 . 3_555 N O1 Sr4 O5 145.50670(30) -10_566 . -9_665 N O1 Sr4 O5 62.9015(10) -10_566 . -10_566 N O1 Sr4 O5 78.7090(20) -10_566 . -11_656 N O1 Sr4 Li2 95.3318(19) -10_566 . 9_556 N O1 Sr4 Li3 84.6682(19) -10_566 . 1_555 N O1 Sr4 Sr5 139.0257(9) -10_566 . 4_555 N O1 Sr4 Sr5 95.9081 -10_566 . 5_555 N O1 Sr4 Sr5 44.5831(10) -10_566 . 6_555 N O1 Sr4 O4 131.6698(8) -11_656 . 1_555 N O1 Sr4 O4 73.31530(10) -11_656 . 2_555 N O1 Sr4 O4 55.7340(6) -11_656 . 3_555 N O1 Sr4 O5 78.70900(10) -11_656 . -9_665 N O1 Sr4 O5 145.5067(5) -11_656 . -10_566 N O1 Sr4 O5 62.9015(13) -11_656 . -11_656 N O1 Sr4 Li2 95.33180(30) -11_656 . 9_556 N O1 Sr4 Li3 84.66820(30) -11_656 . 1_555 N O1 Sr4 Sr5 44.5831 -11_656 . 4_555 N O1 Sr4 Sr5 139.02570(10) -11_656 . 5_555 N O1 Sr4 Sr5 95.90810(30) -11_656 . 6_555 N O4 Sr4 O4 80.6322(5) 1_555 . 2_555 N O4 Sr4 O4 80.6322(15) 1_555 . 3_555 N O4 Sr4 O5 118.6349(10) 1_555 . -9_665 N O4 Sr4 O5 82.7888(13) 1_555 . -10_566 N O4 Sr4 O5 152.00070(10) 1_555 . -11_656 N O4 Sr4 Li2 131.6605(5) 1_555 . 9_556 N O4 Sr4 Li3 48.3395(5) 1_555 . 1_555 N O4 Sr4 Sr5 147.6226(10) 1_555 . 4_555 N O4 Sr4 Sr5 75.76030(10) 1_555 . 5_555 N O4 Sr4 Sr5 116.3403(10) 1_555 . 6_555 N O4 Sr4 O4 80.6322(10) 2_555 . 3_555 N O4 Sr4 O5 152.0007 2_555 . -9_665 N O4 Sr4 O5 118.6349(9) 2_555 . -10_566 N O4 Sr4 O5 82.7888(5) 2_555 . -11_656 N O4 Sr4 Li2 131.6605(14) 2_555 . 9_556 N O4 Sr4 Li3 48.3395(14) 2_555 . 1_555 N O4 Sr4 Sr5 116.3403 2_555 . 4_555 N O4 Sr4 Sr5 147.62260(10) 2_555 . 5_555 N O4 Sr4 Sr5 75.76030(20) 2_555 . 6_555 N O4 Sr4 O5 82.7888(8) 3_555 . -9_665 N O4 Sr4 O5 152.00070(10) 3_555 . -10_566 N O4 Sr4 O5 118.6349(19) 3_555 . -11_656 N O4 Sr4 Li2 131.6605(8) 3_555 . 9_556 N O4 Sr4 Li3 48.3395(8) 3_555 . 1_555 N O4 Sr4 Sr5 75.76030(20) 3_555 . 4_555 N O4 Sr4 Sr5 116.3403(10) 3_555 . 5_555 N O4 Sr4 Sr5 147.6226(11) 3_555 . 6_555 N O5 Sr4 O5 85.5917(7) -9_665 . -10_566 N O5 Sr4 O5 85.5917(11) -9_665 . -11_656 N O5 Sr4 Li2 51.6735(16) -9_665 . 9_556 N O5 Sr4 Li3 128.3264(16) -9_665 . 1_555 N O5 Sr4 Sr5 36.94800(10) -9_665 . 4_555 N O5 Sr4 Sr5 60.3767 -9_665 . 5_555 N O5 Sr4 Sr5 108.7298(4) -9_665 . 6_555 N O5 Sr4 O5 85.5917(18) -10_566 . -11_656 N O5 Sr4 Li2 51.6735(7) -10_566 . 9_556 N O5 Sr4 Li3 128.3264(7) -10_566 . 1_555 N O5 Sr4 Sr5 108.72980(10) -10_566 . 4_555 N O5 Sr4 Sr5 36.9480(10) -10_566 . 5_555 N O5 Sr4 Sr5 60.3767(11) -10_566 . 6_555 N O5 Sr4 Li2 51.6735(9) -11_656 . 9_556 N O5 Sr4 Li3 128.3264(9) -11_656 . 1_555 N O5 Sr4 Sr5 60.3767(11) -11_656 . 4_555 N O5 Sr4 Sr5 108.7298(4) -11_656 . 5_555 N O5 Sr4 Sr5 36.9480(11) -11_656 . 6_555 N Li2 Sr4 Li3 180.0 9_556 . 1_555 N Li2 Sr4 Sr5 58.4891(6) 9_556 . 4_555 N Li2 Sr4 Sr5 58.4891(6) 9_556 . 5_555 N Li2 Sr4 Sr5 58.4891(12) 9_556 . 6_555 N Li3 Sr4 Sr5 121.5109(6) 1_555 . 4_555 N Li3 Sr4 Sr5 121.5109(6) 1_555 . 5_555 N Li3 Sr4 Sr5 121.5109(12) 1_555 . 6_555 N Sr5 Sr4 Sr5 95.1773 4_555 . 5_555 N Sr5 Sr4 Sr5 95.17730(10) 4_555 . 6_555 N Sr5 Sr4 Sr5 95.17730(10) 5_555 . 6_555 N Ca2 Ce4 Ca3 180.0 9_556 . 1_555 N Ca2 Ce4 O4 131.6605(5) 9_556 . 1_555 N Ca2 Ce4 O4 131.6605(14) 9_556 . 2_555 N Ca2 Ce4 O4 131.6605(8) 9_556 . 3_555 N Ca2 Ce4 O5 51.6735(16) 9_556 . -9_665 N Ca2 Ce4 O5 51.6735(7) 9_556 . -10_566 N Ca2 Ce4 O5 51.6735(9) 9_556 . -11_656 N Ca2 Ce4 Li2 0.0 9_556 . 9_556 N Ca2 Ce4 Li3 180.0 9_556 . 1_555 N Ca3 Ce4 O4 48.3395(5) 1_555 . 1_555 N Ca3 Ce4 O4 48.3395(14) 1_555 . 2_555 N Ca3 Ce4 O4 48.3395(8) 1_555 . 3_555 N Ca3 Ce4 O5 128.3264(16) 1_555 . -9_665 N Ca3 Ce4 O5 128.3264(7) 1_555 . -10_566 N Ca3 Ce4 O5 128.3264(9) 1_555 . -11_656 N Ca3 Ce4 Li2 180.0 1_555 . 9_556 N Ca3 Ce4 Li3 0.0 1_555 . 1_555 N O4 Ce4 O4 80.6322(5) 1_555 . 2_555 N O4 Ce4 O4 80.6322(15) 1_555 . 3_555 N O4 Ce4 O5 118.6349(10) 1_555 . -9_665 N O4 Ce4 O5 82.7888(13) 1_555 . -10_566 N O4 Ce4 O5 152.00070(10) 1_555 . -11_656 N O4 Ce4 Li2 131.6605(5) 1_555 . 9_556 N O4 Ce4 Li3 48.3395(5) 1_555 . 1_555 N O4 Ce4 O4 80.6322(10) 2_555 . 3_555 N O4 Ce4 O5 152.0007 2_555 . -9_665 N O4 Ce4 O5 118.6349(9) 2_555 . -10_566 N O4 Ce4 O5 82.7888(5) 2_555 . -11_656 N O4 Ce4 Li2 131.6605(14) 2_555 . 9_556 N O4 Ce4 Li3 48.3395(14) 2_555 . 1_555 N O4 Ce4 O5 82.7888(8) 3_555 . -9_665 N O4 Ce4 O5 152.00070(10) 3_555 . -10_566 N O4 Ce4 O5 118.6349(19) 3_555 . -11_656 N O4 Ce4 Li2 131.6605(8) 3_555 . 9_556 N O4 Ce4 Li3 48.3395(8) 3_555 . 1_555 N O5 Ce4 O5 85.5917(7) -9_665 . -10_566 N O5 Ce4 O5 85.5917(11) -9_665 . -11_656 N O5 Ce4 Li2 51.6735(16) -9_665 . 9_556 N O5 Ce4 Li3 128.3264(16) -9_665 . 1_555 N O5 Ce4 O5 85.5917(18) -10_566 . -11_656 N O5 Ce4 Li2 51.6735(7) -10_566 . 9_556 N O5 Ce4 Li3 128.3264(7) -10_566 . 1_555 N O5 Ce4 Li2 51.6735(9) -11_656 . 9_556 N O5 Ce4 Li3 128.3264(9) -11_656 . 1_555 N Li2 Ce4 Li3 180.0 9_556 . 1_555 N Ca2 Sr5 Ca3 179.0453 2_555 . 1_555 N Ca2 Sr5 Ca4 49.8822(4) 2_555 . 4_455 N Ca2 Sr5 Ca5 55.2742(11) 2_555 . -7_464 N Ca2 Sr5 Ca5 55.2742(6) 2_555 . -9_564 N Ca2 Sr5 Ca6 122.2378(7) 2_555 . 1_555 N Ca2 Sr5 Ca6 121.1947(12) 2_555 . 2_555 N Ca2 Sr5 Al1 68.4387(10) 2_555 . 2_555 N Ca2 Sr5 Al1 68.4821(10) 2_555 . -12_654 N Ca2 Sr5 Al2 104.5025(21) 2_555 . 1_555 N Ca2 Sr5 Al2 107.9003(10) 2_555 . 2_555 N Ca2 Sr5 Al2 102.8866(10) 2_555 . -9_564 N Ca2 Sr5 O1 86.85880(10) 2_555 . 2_555 N Ca2 Sr5 O2 89.86760(30) 2_555 . 2_555 N Ca2 Sr5 O3 134.3208(13) 2_555 . 1_555 N Ca2 Sr5 O3 135.1650(8) 2_555 . 2_555 N Ca2 Sr5 O4 131.5349(9) 2_555 . 1_555 N Ca2 Sr5 O5 46.8124(15) 2_555 . -6_566 N Ca2 Sr5 Li2 0.0 2_555 . 2_555 N Ca2 Sr5 Li3 179.0453 2_555 . 1_555 N Ca2 Sr5 Sr4 49.8822(4) 2_555 . 4_455 N Ca2 Sr5 Sr5 55.2742(11) 2_555 . -7_565 N Ca2 Sr5 Sr5 55.2742(6) 2_555 . -9_665 N Ca3 Sr5 Ca4 129.8444(5) 1_555 . 4_455 N Ca3 Sr5 Ca5 125.6579(11) 1_555 . -7_464 N Ca3 Sr5 Ca5 124.0469(6) 1_555 . -9_564 N Ca3 Sr5 Ca6 58.0650(7) 1_555 . 1_555 N Ca3 Sr5 Ca6 57.8843(13) 1_555 . 2_555 N Ca3 Sr5 Al1 112.2145(10) 1_555 . 2_555 N Ca3 Sr5 Al1 111.7463(10) 1_555 . -12_654 N Ca3 Sr5 Al2 76.4454(22) 1_555 . 1_555 N Ca3 Sr5 Al2 71.9203(10) 1_555 . 2_555 N Ca3 Sr5 Al2 76.5053(10) 1_555 . -9_564 N Ca3 Sr5 O1 93.29920(10) 1_555 . 2_555 N Ca3 Sr5 O2 90.00800(30) 1_555 . 2_555 N Ca3 Sr5 O3 46.4870(13) 1_555 . 1_555 N Ca3 Sr5 O3 44.3204(8) 1_555 . 2_555 N Ca3 Sr5 O4 47.6009(9) 1_555 . 1_555 N Ca3 Sr5 O5 132.2787(15) 1_555 . -6_566 N Ca3 Sr5 Li2 179.0453 1_555 . 2_555 N Ca3 Sr5 Li3 0.0 1_555 . 1_555 N Ca3 Sr5 Sr4 129.8444(5) 1_555 . 4_455 N Ca3 Sr5 Sr5 125.6579(11) 1_555 . -7_565 N Ca3 Sr5 Sr5 124.0469(6) 1_555 . -9_665 N Ca4 Sr5 Ca5 86.22110(10) 4_455 . -7_464 N Ca4 Sr5 Ca5 86.2211 4_455 . -9_564 N Ca4 Sr5 Ca6 171.96460(20) 4_455 . 1_555 N Ca4 Sr5 Ca6 89.58340(30) 4_455 . 2_555 N Ca4 Sr5 Al1 53.3508(4) 4_455 . 2_555 N Ca4 Sr5 Al1 118.3292(6) 4_455 . -12_654 N Ca4 Sr5 Al2 116.7898(6) 4_455 . 1_555 N Ca4 Sr5 Al2 58.2261(5) 4_455 . 2_555 N Ca4 Sr5 Al2 124.15230(20) 4_455 . -9_564 N Ca4 Sr5 O1 43.7241 4_455 . 2_555 N Ca4 Sr5 O2 134.30490(10) 4_455 . 2_555 N Ca4 Sr5 O3 149.44820(20) 4_455 . 1_555 N Ca4 Sr5 O3 86.59970(30) 4_455 . 2_555 N Ca4 Sr5 O4 120.9143(7) 4_455 . 1_555 N Ca4 Sr5 O5 41.03230(20) 4_455 . -6_566 N Ca4 Sr5 Li2 49.8822(4) 4_455 . 2_555 N Ca4 Sr5 Li3 129.8444(5) 4_455 . 1_555 N Ca4 Sr5 Sr4 0.0 4_455 . 4_455 N Ca4 Sr5 Sr5 86.22110(10) 4_455 . -7_565 N Ca4 Sr5 Sr5 86.2211 4_455 . -9_665 N Ca5 Sr5 Ca5 92.33980(10) -7_464 . -9_564 N Ca5 Sr5 Ca6 87.14400(20) -7_455 . 1_555 N Ca5 Sr5 Ca6 175.76390(20) -7_455 . 2_555 N Ca5 Sr5 Al1 52.9543(10) -7_554 . 2_555 N Ca5 Sr5 Al1 56.7090(11) -7_554 . -12_654 N Ca5 Sr5 Al2 49.5174(11) -7_464 . 1_555 N Ca5 Sr5 Al2 119.0211(11) -7_464 . 2_555 N Ca5 Sr5 Al2 119.6314(9) -7_464 . -9_564 N Ca5 Sr5 O1 90.52030(10) -7_455 . 2_555 N Ca5 Sr5 O2 85.91360(30) -7_565 . 2_555 N Ca5 Sr5 O3 81.12190(30) -7_565 . 1_555 N Ca5 Sr5 O3 144.7417(11) -7_565 . 2_555 N Ca5 Sr5 O4 150.1098(9) -7_565 . 1_555 N Ca5 Sr5 O5 101.9213(4) -7_565 . -6_566 N Ca5 Sr5 Li2 55.2742(11) -7_565 . 2_555 N Ca5 Sr5 Li3 125.6579(11) -7_565 . 1_555 N Ca5 Sr5 Sr4 86.22110(10) -7_565 . 4_455 N Ca5 Sr5 Sr5 0.0 -7_565 . -7_565 N Ca5 Sr5 Sr5 92.33980(10) -7_565 . -9_665 N Ca5 Sr5 Ca6 89.5275 -9_555 . 1_555 N Ca5 Sr5 Ca6 86.79300(10) -9_555 . 2_555 N Ca5 Sr5 Al1 123.6872(5) -9_654 . 2_555 N Ca5 Sr5 Al1 53.0468(6) -9_654 . -12_654 N Ca5 Sr5 Al2 129.5315(7) -9_564 . 1_555 N Ca5 Sr5 Al2 127.6881(5) -9_564 . 2_555 N Ca5 Sr5 Al2 47.8924(4) -9_564 . -9_564 N Ca5 Sr5 O1 129.5268 -9_555 . 2_555 N Ca5 Sr5 O2 49.285 -9_665 . 2_555 N Ca5 Sr5 O3 121.8069 -9_665 . 1_555 N Ca5 Sr5 O3 121.5389(10) -9_665 . 2_555 N Ca5 Sr5 O4 78.42660(30) -9_665 . 1_555 N Ca5 Sr5 O5 48.42780(10) -9_665 . -6_566 N Ca5 Sr5 Li2 55.2742(6) -9_665 . 2_555 N Ca5 Sr5 Li3 124.0469(6) -9_665 . 1_555 N Ca5 Sr5 Sr4 86.2211 -9_665 . 4_455 N Ca5 Sr5 Sr5 92.33980(10) -9_665 . -7_565 N Ca5 Sr5 Sr5 0.0 -9_665 . -9_665 N Ca6 Sr5 Ca6 96.9912 1_555 . 2_555 N Ca6 Sr5 Al1 124.8203(7) 1_555 . 2_555 N Ca6 Sr5 Al1 53.9046(4) 1_555 . -12_654 N Ca6 Sr5 Al2 61.37140(30) 1_555 . 1_555 N Ca6 Sr5 Al2 129.38609(30) 1_555 . 2_555 N Ca6 Sr5 Al2 56.1221(5) 1_555 . -9_564 N Ca6 Sr5 O1 140.9449 1_555 . 2_555 N Ca6 Sr5 O2 40.4539 1_555 . 2_555 N Ca6 Sr5 O3 32.7955 1_555 . 1_555 N Ca6 Sr5 O3 101.43570(10) 1_555 . 2_555 N Ca6 Sr5 O4 64.6595(10) 1_555 . 1_555 N Ca6 Sr5 O5 136.7893 1_555 . -6_566 N Ca6 Sr5 Li2 122.2378(7) 1_555 . 2_555 N Ca6 Sr5 Li3 58.0650(7) 1_555 . 1_555 N Ca6 Sr5 Sr4 171.96460(20) 1_555 . 4_455 N Ca6 Sr5 Sr5 87.14400(20) 1_555 . -7_565 N Ca6 Sr5 Sr5 89.5275 1_555 . -9_665 N Ca6 Sr5 Al1 124.4571(11) 2_555 . 2_555 N Ca6 Sr5 Al1 125.3151(10) 2_555 . -12_654 N Ca6 Sr5 Al2 133.5934(9) 2_555 . 1_555 N Ca6 Sr5 Al2 58.8098(10) 2_555 . 2_555 N Ca6 Sr5 Al2 62.5259(9) 2_555 . -9_564 N Ca6 Sr5 O1 86.8452 2_555 . 2_555 N Ca6 Sr5 O2 96.62640(20) 2_555 . 2_555 N Ca6 Sr5 O3 102.85720(10) 2_555 . 1_555 N Ca6 Sr5 O3 35.2314(11) 2_555 . 2_555 N Ca6 Sr5 O4 33.5757(11) 2_555 . 1_555 N Ca6 Sr5 O5 74.42570(20) 2_555 . -6_566 N Ca6 Sr5 Li2 121.1947(12) 2_555 . 2_555 N Ca6 Sr5 Li3 57.8843(13) 2_555 . 1_555 N Ca6 Sr5 Sr4 89.58340(30) 2_555 . 4_455 N Ca6 Sr5 Sr5 175.76390(20) 2_555 . -7_565 N Ca6 Sr5 Sr5 86.79300(10) 2_555 . -9_665 N Al1 Sr5 Al1 109.3912(21) 2_555 . -12_654 N Al1 Sr5 Al2 63.6106(10) 2_555 . 1_555 N Al1 Sr5 Al2 66.2074(20) 2_555 . 2_555 N Al1 Sr5 Al2 170.65010(10) 2_555 . -9_564 N Al1 Sr5 O1 37.6144(11) 2_555 . 2_555 N Al1 Sr5 O2 138.8647(13) 2_555 . 2_555 N Al1 Sr5 O3 97.5317(5) 2_555 . 1_555 N Al1 Sr5 O3 96.0754(19) 2_555 . 2_555 N Al1 Sr5 O4 152.92120(20) 2_555 . 1_555 N Al1 Sr5 O5 92.2469(5) 2_555 . -6_566 N Al1 Sr5 Li2 68.4387(10) 2_555 . 2_555 N Al1 Sr5 Li3 112.2145(10) 2_555 . 1_555 N Al1 Sr5 Sr4 53.3508(4) 2_555 . 4_455 N Al1 Sr5 Sr5 52.9543(10) 2_555 . -7_565 N Al1 Sr5 Sr5 123.6872(5) 2_555 . -9_665 N Al1 Sr5 Al2 76.8439(13) -12_564 . 1_555 N Al1 Sr5 Al2 175.38560(10) -12_564 . 2_555 N Al1 Sr5 Al2 62.9227(20) -12_564 . -9_564 N Al1 Sr5 O1 146.2243(9) -12_555 . 2_555 N Al1 Sr5 O2 29.9664(8) -12_665 . 2_555 N Al1 Sr5 O3 76.92670(20) -12_665 . 1_555 N Al1 Sr5 O3 151.67830(30) -12_665 . 2_555 N Al1 Sr5 O4 96.3879(20) -12_665 . 1_555 N Al1 Sr5 O5 96.2016(4) -12_665 . -6_566 N Al1 Sr5 Li2 68.4821(10) -12_665 . 2_555 N Al1 Sr5 Li3 111.7463(10) -12_665 . 1_555 N Al1 Sr5 Sr4 118.3292(6) -12_665 . 4_455 N Al1 Sr5 Sr5 56.7090(11) -12_665 . -7_565 N Al1 Sr5 Sr5 53.0468(6) -12_665 . -9_665 N Al2 Sr5 Al2 101.7478(12) 1_555 . 2_555 N Al2 Sr5 Al2 117.1936(8) 1_555 . -9_564 N Al2 Sr5 O1 88.07140(10) 1_555 . 2_555 N Al2 Sr5 O2 90.75130(30) 1_555 . 2_555 N Al2 Sr5 O3 36.9493(6) 1_555 . 1_555 N Al2 Sr5 O3 105.0180(18) 1_555 . 2_555 N Al2 Sr5 O4 116.7792(14) 1_555 . 1_555 N Al2 Sr5 O5 149.7528(6) 1_555 . -6_566 N Al2 Sr5 Li2 104.5025(21) 1_555 . 2_555 N Al2 Sr5 Li3 76.4454(22) 1_555 . 1_555 N Al2 Sr5 Sr4 116.7898(6) 1_555 . 4_455 N Al2 Sr5 Sr5 49.5174(11) 1_555 . -7_565 N Al2 Sr5 Sr5 129.5315(7) 1_555 . -9_665 N Al2 Sr5 Al2 121.3087(19) 2_555 . -9_564 N Al2 Sr5 O1 29.2009(9) 2_555 . 2_555 N Al2 Sr5 O2 154.5911(8) 2_555 . 2_555 N Al2 Sr5 O3 104.66490(20) 2_555 . 1_555 N Al2 Sr5 O3 32.87530(20) 2_555 . 2_555 N Al2 Sr5 O4 88.1726(19) 2_555 . 1_555 N Al2 Sr5 O5 82.8108(4) 2_555 . -6_566 N Al2 Sr5 Li2 107.9003(10) 2_555 . 2_555 N Al2 Sr5 Li3 71.9203(10) 2_555 . 1_555 N Al2 Sr5 Sr4 58.2261(5) 2_555 . 4_455 N Al2 Sr5 Sr5 119.0211(11) 2_555 . -7_565 N Al2 Sr5 Sr5 127.6881(5) 2_555 . -9_665 N Al2 Sr5 O1 148.6774(10) -9_555 . 2_555 N Al2 Sr5 O2 34.4528(11) -9_665 . 2_555 N Al2 Sr5 O3 86.09920(30) -9_665 . 1_555 N Al2 Sr5 O3 92.6560(19) -9_665 . 2_555 N Al2 Sr5 O4 36.18480(10) -9_665 . 1_555 N Al2 Sr5 O5 83.65540(30) -9_665 . -6_566 N Al2 Sr5 Li2 102.8866(10) -9_665 . 2_555 N Al2 Sr5 Li3 76.5053(10) -9_665 . 1_555 N Al2 Sr5 Sr4 124.15230(20) -9_665 . 4_455 N Al2 Sr5 Sr5 119.6314(9) -9_665 . -7_565 N Al2 Sr5 Sr5 47.8924(4) -9_665 . -9_665 N O1 Sr5 O2 176.12869(10) 2_555 . 2_555 N O1 Sr5 O3 108.4201 2_555 . 1_555 N O1 Sr5 O3 61.3476(7) 2_555 . 2_555 N O1 Sr5 O4 117.3710(10) 2_555 . 1_555 N O1 Sr5 O5 81.7455 2_555 . -6_566 N O1 Sr5 Li2 86.85880(10) 2_555 . 2_555 N O1 Sr5 Li3 93.29920(10) 2_555 . 1_555 N O1 Sr5 Sr4 43.7241 2_555 . 4_455 N O1 Sr5 Sr5 90.52030(10) 2_555 . -7_565 N O1 Sr5 Sr5 129.5268 2_555 . -9_665 N O2 Sr5 O3 72.5365 2_555 . 1_555 N O2 Sr5 O3 122.5235(6) 2_555 . 2_555 N O2 Sr5 O4 66.4225(11) 2_555 . 1_555 N O2 Sr5 O5 97.50420(10) 2_555 . -6_566 N O2 Sr5 Li2 89.86760(30) 2_555 . 2_555 N O2 Sr5 Li3 90.00800(30) 2_555 . 1_555 N O2 Sr5 Sr4 134.30490(10) 2_555 . 4_455 N O2 Sr5 Sr5 85.91360(30) 2_555 . -7_565 N O2 Sr5 Sr5 49.285 2_555 . -9_665 N O3 Sr5 O3 87.9029(6) 1_555 . 2_555 N O3 Sr5 O4 79.9447(9) 1_555 . 1_555 N O3 Sr5 O5 169.4805 1_555 . -6_566 N O3 Sr5 Li2 134.3208(13) 1_555 . 2_555 N O3 Sr5 Li3 46.4870(13) 1_555 . 1_555 N O3 Sr5 Sr4 149.44820(20) 1_555 . 4_455 N O3 Sr5 Sr5 81.12190(30) 1_555 . -7_565 N O3 Sr5 Sr5 121.8069 1_555 . -9_665 N O3 Sr5 O4 57.0182(18) 2_555 . 1_555 N O3 Sr5 O5 94.9355(9) 2_555 . -6_566 N O3 Sr5 Li2 135.1650(8) 2_555 . 2_555 N O3 Sr5 Li3 44.3204(8) 2_555 . 1_555 N O3 Sr5 Sr4 86.59970(30) 2_555 . 4_455 N O3 Sr5 Sr5 144.7417(11) 2_555 . -7_565 N O3 Sr5 Sr5 121.5389(10) 2_555 . -9_665 N O4 Sr5 O5 93.0891(8) 1_555 . -6_566 N O4 Sr5 Li2 131.5349(9) 1_555 . 2_555 N O4 Sr5 Li3 47.6009(9) 1_555 . 1_555 N O4 Sr5 Sr4 120.9143(7) 1_555 . 4_455 N O4 Sr5 Sr5 150.1098(9) 1_555 . -7_565 N O4 Sr5 Sr5 78.42660(30) 1_555 . -9_665 N O5 Sr5 Li2 46.8124(15) -6_566 . 2_555 N O5 Sr5 Li3 132.2787(15) -6_566 . 1_555 N O5 Sr5 Sr4 41.03230(20) -6_566 . 4_455 N O5 Sr5 Sr5 101.9213(4) -6_566 . -7_565 N O5 Sr5 Sr5 48.42780(10) -6_566 . -9_665 N Li2 Sr5 Li3 179.0453 2_555 . 1_555 N Li2 Sr5 Sr4 49.8822(4) 2_555 . 4_455 N Li2 Sr5 Sr5 55.2742(11) 2_555 . -7_565 N Li2 Sr5 Sr5 55.2742(6) 2_555 . -9_665 N Li3 Sr5 Sr4 129.8444(5) 1_555 . 4_455 N Li3 Sr5 Sr5 125.6579(11) 1_555 . -7_565 N Li3 Sr5 Sr5 124.0469(6) 1_555 . -9_665 N Sr4 Sr5 Sr5 86.22110(10) 4_455 . -7_565 N Sr4 Sr5 Sr5 86.2211 4_455 . -9_665 N Sr5 Sr5 Sr5 92.33980(10) -7_565 . -9_665 N Ca2 Ce5 Ca3 179.0453 2_555 . 1_555 N Ca2 Ce5 Ca6 122.2378(7) 2_555 . 1_555 N Ca2 Ce5 Ca6 121.1947(12) 2_555 . 2_555 N Ca2 Ce5 Al2 104.5025(21) 2_555 . 1_555 N Ca2 Ce5 Al2 102.8866(10) 2_555 . -9_564 N Ca2 Ce5 O2 89.86760(30) 2_555 . 2_555 N Ca2 Ce5 O3 134.3208(13) 2_555 . 1_555 N Ca2 Ce5 O5 46.8124(15) 2_555 . -6_566 N Ca2 Ce5 Li3 179.0453 2_555 . 1_555 N Ca3 Ce5 Ca6 58.0650(7) 1_555 . 1_555 N Ca3 Ce5 Ca6 57.8843(13) 1_555 . 2_555 N Ca3 Ce5 Al2 76.4454(22) 1_555 . 1_555 N Ca3 Ce5 Al2 76.5053(10) 1_555 . -9_564 N Ca3 Ce5 O2 90.00800(30) 1_555 . 2_555 N Ca3 Ce5 O3 46.4870(13) 1_555 . 1_555 N Ca3 Ce5 O5 132.2787(15) 1_555 . -6_566 N Ca3 Ce5 Li3 0.0 1_555 . 1_555 N Ca6 Ce5 Ca6 96.9912 1_555 . 2_555 N Ca6 Ce5 Al2 61.37140(30) 1_555 . 1_555 N Ca6 Ce5 Al2 56.1221(5) 1_555 . -9_564 N Ca6 Ce5 O2 40.4539 1_555 . 2_555 N Ca6 Ce5 O3 32.7955 1_555 . 1_555 N Ca6 Ce5 O5 136.7893 1_555 . -6_566 N Ca6 Ce5 Li3 58.0650(7) 1_555 . 1_555 N Ca6 Ce5 Al2 133.5934(9) 2_555 . 1_555 N Ca6 Ce5 Al2 62.5259(9) 2_555 . -9_564 N Ca6 Ce5 O2 96.62640(20) 2_555 . 2_555 N Ca6 Ce5 O3 102.85720(10) 2_555 . 1_555 N Ca6 Ce5 O5 74.42570(20) 2_555 . -6_566 N Ca6 Ce5 Li3 57.8843(13) 2_555 . 1_555 N Al2 Ce5 Al2 117.1936(8) 1_555 . -9_564 N Al2 Ce5 O2 90.75130(30) 1_555 . 2_555 N Al2 Ce5 O3 36.9493(6) 1_555 . 1_555 N Al2 Ce5 O5 149.7528(6) 1_555 . -6_566 N Al2 Ce5 Li3 76.4454(22) 1_555 . 1_555 N Al2 Ce5 O2 34.4528(11) -9_665 . 2_555 N Al2 Ce5 O3 86.09920(30) -9_665 . 1_555 N Al2 Ce5 O5 83.65540(30) -9_665 . -6_566 N Al2 Ce5 Li3 76.5053(10) -9_665 . 1_555 N O2 Ce5 O3 72.5365 2_555 . 1_555 N O2 Ce5 O5 97.50420(10) 2_555 . -6_566 N O2 Ce5 Li3 90.00800(30) 2_555 . 1_555 N O3 Ce5 O5 169.4805 1_555 . -6_566 N O3 Ce5 Li3 46.4870(13) 1_555 . 1_555 N O5 Ce5 Li3 132.2787(15) -6_566 . 1_555 N # Powder diffraction data for histogram 1 #============================================================================== # 9. INSTRUMENT CHARACTERIZATION _exptl_special_details ; ? ; # if regions of the data are excluded, the reason(s) are supplied here: _pd_proc_info_excluded_regions ; ? ; # The following item is used to identify the equipment used to record # the powder pattern when the diffractogram was measured at a laboratory # other than the authors' home institution, e.g. when neutron or synchrotron # radiation is used. _pd_instr_location ; ? ; _pd_calibration_special_details # description of the method used # to calibrate the instrument ; ? ; _diffrn_ambient_temperature ? _diffrn_source ? _diffrn_source_target ? _diffrn_source_type ? _diffrn_measurement_device_type ? _diffrn_detector ? _diffrn_detector_type ? # make or model of detector _pd_meas_scan_method ? # options are 'step', 'cont', # 'tof', 'fixed' or # 'disp' (= dispersive) _pd_meas_special_details ; ? ; # The following two items identify the program(s) used (if appropriate). _computing_data_collection ? _computing_data_reduction ? # Describe any processing performed on the data, prior to refinement. # For example: a manual Lp correction or a precomputed absorption correction _pd_proc_info_data_reduction ? # The following item is used for angular dispersive measurements only. _diffrn_radiation_monochromator ? # The following items are used to define the size of the instrument. # Not all distances are appropriate for all instrument types. _pd_instr_dist_src/mono ? _pd_instr_dist_mono/spec ? _pd_instr_dist_src/spec ? _pd_instr_dist_spec/anal ? _pd_instr_dist_anal/detc ? _pd_instr_dist_spec/detc ? # 10. Specimen size and mounting information # The next three fields give the specimen dimensions in mm. The equatorial # plane contains the incident and diffracted beam. _pd_spec_size_axial ? # perpendicular to # equatorial plane _pd_spec_size_equat ? # parallel to # scattering vector # in transmission _pd_spec_size_thick ? # parallel to # scattering vector # in reflection _pd_spec_mounting # This field should be # used to give details of the # container. ; ? ; _pd_spec_mount_mode ? # options are 'reflection' # or 'transmission' _pd_spec_shape ? # options are 'cylinder' # 'flat_sheet' or 'irregular' loop_ _atom_type_symbol _atom_type_number_in_cell _atom_type_scat_dispersion_real _atom_type_scat_dispersion_imag _atom_type_scat_Cromer_Mann_a1 _atom_type_scat_Cromer_Mann_a2 _atom_type_scat_Cromer_Mann_a3 _atom_type_scat_Cromer_Mann_a4 _atom_type_scat_Cromer_Mann_b1 _atom_type_scat_Cromer_Mann_b2 _atom_type_scat_Cromer_Mann_b3 _atom_type_scat_Cromer_Mann_b4 _atom_type_scat_Cromer_Mann_c _atom_type_scat_source Ca+2 54.72 0.000 0.000 15.6348 -0.0074 7.95180 0.60890 8.43720 10.3116 0.85370 25.9905 -14.875 International_Tables_Vol_C Al+3 48.0 0.000 0.000 4.17448 1.93816 3.38760 4.14553 1.20296 0.22875 0.52814 8.28524 0.70679 International_Tables_Vol_C O-2 144.0 0.000 0.000 3.76936 15.0797 2.53342 6.30430 1.91579 40.3445 1.55094 0.31291 0.22789 International_Tables_Vol_C Li+1 2.64 0.000 0.000 0.69680 4.62370 0.78880 1.95570 0.34140 0.63160 0.15630 10.0953 0.01670 International_Tables_Vol_C Sr+2 12.0 0.000 0.000 18.0874 1.49070 8.13730 12.6963 2.56540 24.5651 -34.193 -0.0138 41.4025 International_Tables_Vol_C Ce+3 2.64 0.000 0.000 20.8036 2.77691 19.5590 0.23154 11.9369 16.5408 0.61238 43.1692 2.09013 International_Tables_Vol_C _diffrn_radiation_probe x-ray _diffrn_radiation_polarisn_ratio ? loop_ _diffrn_radiation_wavelength _diffrn_radiation_wavelength_wt _diffrn_radiation_type _diffrn_radiation_wavelength_id 1.540600 1.000 K\a~1~ 1 1.544400 0.500 K\a~2~ 2 _pd_proc_ls_prof_R_factor 0.0411 _pd_proc_ls_prof_wR_factor 0.0584 _pd_proc_ls_prof_wR_expected 0.0375 _refine_ls_R_Fsqd_factor 0.14667 _pd_proc_ls_background_function ; GSAS Background function number 1 with 6 terms. Shifted Chebyshev function of 1st kind 1: 584.943 2: -1.60213 3: -7.79782 4: -0.258682 5: -8.05255 6: 0.596317 ; _exptl_absorpt_process_details ; GSAS Absorption/surface roughness correction: function number 0 No correction is applied. ; _exptl_absorpt_correction_T_min 1.00000 _exptl_absorpt_correction_T_max 1.00000 # Extinction correction _gsas_exptl_extinct_corr_T_min 1.00000 _gsas_exptl_extinct_corr_T_max 1.00000 _pd_proc_ls_profile_function ; CW Profile function number 3 with 19 terms Pseudovoigt profile coefficients as parameterized in P. Thompson, D.E. Cox & J.B. Hastings (1987). J. Appl. Cryst.,20,79-83. Asymmetry correction of L.W. Finger, D.E. Cox & A. P. Jephcoat (1994). J. Appl. Cryst.,27,892-900. #1(GU) = 0.000 #2(GV) = 24.234 #3(GW) = 7.699 #4(GP) = 0.000 #5(LX) = 3.227 #6(LY) = 0.896 #7(S/L) = 0.0290 #8(H/L) = 0.0327 #9(trns) = -2.20 #10(shft)= -15.3251 #11(stec)= 0.00 #12(ptec)= 0.00 #13(sfec)= 0.00 #14(L11) = 0.000 #15(L22) = 0.000 #16(L33) = 0.000 #17(L12) = 0.000 #18(L13) = 0.000 #19(L23) = 0.000 Peak tails are ignored where the intensity is below 0.0010 times the peak Aniso. broadening axis 0.0 0.0 1.0 ; _pd_proc_ls_peak_cutoff 0.00100 _pd_proc_info_datetime 2016-08-21T12:15:22 _pd_calc_method "Rietveld Refinement" #---- raw/calc data loop ----- _pd_meas_2theta_range_min 10.03 _pd_meas_2theta_range_max 119.91 _pd_meas_2theta_range_inc 0.02 _pd_proc_2theta_range_min 10.0307 _pd_proc_2theta_range_max 119.9107 _pd_proc_2theta_range_inc 0.02 loop_ _pd_meas_counts_total _pd_proc_ls_weight _pd_proc_intensity_bkg_calc _pd_calc_intensity_total 600.0 0.001666 570.35712 683.31805 592.0 0.001694 570.41931 705.63513 599.0 0.001666 570.48145 732.80499 600.0 0.001666 570.54346 759.41943 594.0 0.001680 570.60535 773.61450 578.0 0.001736 570.66711 761.83899 554.0 0.001811 570.72882 723.14355 533.0 0.001874 570.79041 673.78455 549.0 0.001826 570.85193 631.68188 569.0 0.001751 570.91327 604.29181 595.0 0.001680 570.97455 589.64917 627.0 0.001600 571.03571 582.71625 654.0 0.001526 571.09680 579.45416 640.0 0.001562 571.15778 577.69299 608.0 0.001639 571.21863 576.56091 559.0 0.001795 571.27936 575.75385 570.0 0.001751 571.34003 575.14972 590.0 0.001694 571.40057 574.68732 604.0 0.001652 571.46106 574.32843 605.0 0.001652 571.52136 574.04712 597.0 0.001680 571.58167 573.82520 609.0 0.001639 571.64178 573.64954 621.0 0.001613 571.70184 573.51056 630.0 0.001587 571.76178 573.40088 619.0 0.001613 571.82159 573.31494 596.0 0.001680 571.88135 573.24866 570.0 0.001751 571.94098 573.19849 557.0 0.001795 572.00049 573.16187 572.0 0.001751 572.05994 573.13660 583.0 0.001722 572.11926 573.12097 591.0 0.001694 572.17847 573.11371 584.0 0.001708 572.23761 573.11346 580.0 0.001722 572.29663 573.11951 577.0 0.001736 572.35553 573.13086 570.0 0.001751 572.41437 573.14697 562.0 0.001780 572.47308 573.16730 570.0 0.001751 572.53168 573.19128 574.0 0.001736 572.59021 573.21863 570.0 0.001751 572.64862 573.24890 573.0 0.001751 572.70691 573.28180 579.0 0.001722 572.76514 573.31732 590.0 0.001694 572.82324 573.35510 583.0 0.001722 572.88123 573.39508 554.0 0.001811 572.93915 573.43701 565.0 0.001765 572.99695 573.48096 586.0 0.001708 573.05469 573.52673 610.0 0.001639 573.11230 573.57458 617.0 0.001626 573.16980 573.62433 609.0 0.001639 573.22723 573.67615 588.0 0.001708 573.28455 573.73035 569.0 0.001751 573.34174 573.78735 564.0 0.001780 573.39886 573.84845 547.0 0.001826 573.45587 573.91620 521.0 0.001924 573.51276 573.99518 499.0 0.002011 573.56958 574.09326 499.0 0.002011 573.62628 574.21893 565.0 0.001765 573.68292 574.37909 599.0 0.001666 573.73944 574.57587 610.0 0.001639 573.79584 574.80634 602.0 0.001666 573.85217 575.06586 598.0 0.001666 573.90839 575.34924 602.0 0.001666 573.96448 575.52185 607.0 0.001652 574.02051 575.78674 612.0 0.001639 574.07642 576.14368 616.0 0.001626 574.13226 576.52612 630.0 0.001587 574.18799 576.93640 663.0 0.001514 574.24359 577.37976 643.0 0.001550 574.29913 577.86023 602.0 0.001666 574.35455 578.38391 571.0 0.001751 574.40991 578.95966 556.0 0.001795 574.46515 579.59631 564.0 0.001780 574.52026 580.30725 588.0 0.001708 574.57532 581.11053 614.0 0.001626 574.63025 582.03003 617.0 0.001626 574.68512 583.10168 616.0 0.001626 574.73987 584.38190 611.0 0.001639 574.79449 585.96466 588.0 0.001708 574.84906 587.99921 564.0 0.001780 574.90350 590.66736 569.0 0.001751 574.95789 594.02753 582.0 0.001722 575.01215 598.39014 602.0 0.001666 575.06628 601.21051 589.0 0.001694 575.12036 601.80701 579.0 0.001722 575.17432 598.50079 605.0 0.001652 575.22821 592.80634 602.0 0.001666 575.28198 586.96436 576.0 0.001736 575.33569 582.59137 568.0 0.001765 575.38928 580.00055 565.0 0.001765 575.44275 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0.001652 583.40747 618.18518 567.0 0.001765 583.37769 611.81592 592.0 0.001694 583.34784 606.88727 638.0 0.001562 583.31793 603.46069 606.0 0.001652 583.28802 601.46259 584.0 0.001708 583.25800 600.68848 578.0 0.001736 583.22791 600.87024 598.0 0.001666 583.19781 601.72498 622.0 0.001613 583.16760 602.97491 605.0 0.001652 583.13739 604.32965 596.0 0.001680 583.10712 605.47565 598.0 0.001666 583.07672 606.14990 596.0 0.001680 583.04633 606.28564 594.0 0.001680 583.01587 606.09821 594.0 0.001680 582.98535 605.98816 595.0 0.001680 582.95477 606.34027 597.0 0.001680 582.92413 607.39508 608.0 0.001639 582.89343 609.19366 617.0 0.001626 582.86267 611.61121 614.0 0.001626 582.83191 614.12079 616.0 0.001626 582.80103 616.17023 622.0 0.001613 582.77014 617.09546 623.0 0.001600 582.73914 616.47247 623.0 0.001600 582.70813 614.37897 619.0 0.001613 582.67700 611.31989 608.0 0.001639 582.64587 607.91034 594.0 0.001680 582.61469 604.63947 578.0 0.001736 582.58344 602.06433 572.0 0.001751 582.55212 600.42896 588.0 0.001708 582.52075 599.94922 598.0 0.001666 582.48926 600.73981 605.0 0.001652 582.45782 602.80579 601.0 0.001666 582.42627 606.03406 599.0 0.001666 582.39465 610.17706 600.0 0.001666 582.36298 614.85510 591.0 0.001694 582.33124 619.46649 580.0 0.001722 582.29950 623.32343 602.0 0.001666 582.26764 625.77039 615.0 0.001626 582.23578 626.52216 611.0 0.001639 582.20380 625.81976 616.0 0.001626 582.17181 624.23486 623.0 0.001600 582.13971 622.22223 615.0 0.001626 582.10760 620.15851 601.0 0.001666 582.07538 618.39313 581.0 0.001722 582.04315 617.31049 584.0 0.001708 582.01086 617.40985 595.0 0.001680 581.97852 619.13458 616.0 0.001626 581.94611 622.68146 632.0 0.001587 581.91364 628.04803 643.0 0.001550 581.88110 634.81067 648.0 0.001538 581.84851 642.14777 651.0 0.001538 581.81586 648.91803 656.0 0.001526 581.78314 653.74109 657.0 0.001526 581.75037 655.50110 653.0 0.001526 581.71753 653.95337 641.0 0.001562 581.68469 649.80219 627.0 0.001600 581.65173 644.14624 609.0 0.001639 581.61871 637.89594 598.0 0.001666 581.58569 631.67188 592.0 0.001694 581.55255 625.90704 602.0 0.001666 581.51935 621.03522 608.0 0.001639 581.48615 617.49377 602.0 0.001666 581.45282 615.59570 595.0 0.001680 581.41949 615.48413 587.0 0.001708 581.38605 617.06268 603.0 0.001652 581.35260 620.04712 622.0 0.001613 581.31903 623.94403 647.0 0.001550 581.28546 628.06311 645.0 0.001550 581.25183 631.62219 631.0 0.001587 581.21814 634.02625 607.0 0.001652 581.18433 635.12701 595.0 0.001680 581.15051 635.12585 601.0 0.001666 581.11664 634.22656 619.0 0.001613 581.08270 632.27649 638.0 0.001562 581.04871 629.23022 641.0 0.001562 581.01459 624.91583 631.0 0.001587 580.98047 619.62323 604.0 0.001652 580.94629 613.92853 589.0 0.001694 580.91205 608.41620 580.0 0.001722 580.87775 603.52594 587.0 0.001708 580.84338 599.53778 592.0 0.001694 580.80896 596.65320 593.0 0.001680 580.77448 594.81293 590.0 0.001694 580.73993 594.03180 590.0 0.001694 580.70532 594.20575 607.0 0.001652 580.67065 595.17407 614.0 0.001626 580.63593 596.72186 613.0 0.001626 580.60114 598.58038 616.0 0.001626 580.56628 600.39673 616.0 0.001626 580.53137 601.85553 607.0 0.001652 580.49646 602.61584 613.0 0.001626 580.46143 602.57050 631.0 0.001587 580.42633 601.90942 610.0 0.001639 580.39117 600.95715 595.0 0.001680 580.35596 600.16510 599.0 0.001666 580.32068 599.73224 617.0 0.001626 580.28534 599.74786 642.0 0.001562 580.25000 600.14063 649.0 0.001538 580.21454 600.71552 653.0 0.001526 580.17902 601.09265 651.0 0.001538 580.14343 600.97565 641.0 0.001562 580.10785 600.22278 628.0 0.001587 580.07214 598.96405 620.0 0.001613 580.03638 597.51904 616.0 0.001626 580.00055 596.29364 618.0 0.001613 579.96466 595.60406 603.0 0.001652 579.92877 595.81927 585.0 0.001708 579.89276 597.24811 588.0 0.001708 579.85669 600.14575 593.0 0.001680 579.82056 604.65564 600.0 0.001666 579.78436 610.80859 620.0 0.001613 579.74817 618.37994 635.0 0.001575 579.71185 626.89038 614.0 0.001626 579.67548 635.53809 614.0 0.001626 579.63904 643.18298 638.0 0.001562 579.60254 648.46405 652.0 0.001538 579.56598 650.23975 658.0 0.001514 579.52942 648.21832 641.0 0.001562 579.49274 643.13367 622.0 0.001613 579.45599 636.22449 603.0 0.001652 579.41919 628.74384 607.0 0.001652 579.38232 621.49701 615.0 0.001626 579.34540 615.04150 629.0 0.001587 579.30841 609.71814 624.0 0.001600 579.27136 605.75153 608.0 0.001639 579.23425 603.25513 628.0 0.001587 579.19708 602.22528 632.0 0.001587 579.15985 602.55231 597.0 0.001680 579.12256 604.04767 601.0 0.001666 579.08521 606.44965 627.0 0.001600 579.04779 609.81567 610.0 0.001639 579.01031 612.95880 602.0 0.001666 578.97278 615.91260 607.0 0.001652 578.93518 618.50354 589.0 0.001694 578.89752 620.73474 563.0 0.001780 578.85980 622.57434 591.0 0.001694 578.82202 623.90021 624.0 0.001600 578.78412 624.31415 665.0 0.001502 578.74622 623.46350 656.0 0.001526 578.70825 621.33203 633.0 0.001575 578.67023 618.36169 626.0 0.001600 578.63208 615.20660 621.0 0.001613 578.59393 612.48663 618.0 0.001613 578.55566 610.55725 632.0 0.001587 578.51740 609.53522 649.0 0.001538 578.47906 609.29382 669.0 0.001491 578.44061 609.51752 676.0 0.001479 578.40216 609.66278 670.0 0.001491 578.36359 609.32855 658.0 0.001514 578.32501 608.34454 644.0 0.001550 578.28632 606.82489 628.0 0.001587 578.24756 604.94141 627.0 0.001600 578.20874 602.96613 639.0 0.001562 578.16992 601.09277 636.0 0.001575 578.13098 598.90460 629.0 0.001587 578.09198 596.61743 614.0 0.001626 578.05292 594.32056 606.0 0.001652 578.01379 592.19104 603.0 0.001652 577.97467 590.34363 615.0 0.001626 577.93542 588.86652 622.0 0.001613 577.89612 587.81512 612.0 0.001639 577.85675 587.22186 606.0 0.001652 577.81726 587.13110 602.0 0.001666 577.77777 587.47662 609.0 0.001639 577.73822 588.26672 617.0 0.001626 577.69861 589.45990 629.0 0.001587 577.65887 590.96576 631.0 0.001587 577.61914 592.76959 629.0 0.001587 577.57935 594.75079 635.0 0.001575 577.53943 596.84979 633.0 0.001575 577.49951 599.01111 620.0 0.001613 577.45947 601.38574 627.0 0.001600 577.41943 604.23029 636.0 0.001575 577.37927 607.91827 615.0 0.001626 577.33905 612.61584 606.0 0.001652 577.29877 618.27661 614.0 0.001626 577.25848 624.55725 629.0 0.001587 577.21808 630.77771 644.0 0.001550 577.17761 635.93524 652.0 0.001538 577.13708 638.87189 645.0 0.001550 577.09650 638.72980 624.0 0.001600 577.05585 635.45184 611.0 0.001639 577.01508 629.82031 603.0 0.001652 576.97430 622.98199 603.0 0.001652 576.93347 616.00555 601.0 0.001666 576.89258 609.70367 596.0 0.001680 576.85156 604.63708 602.0 0.001666 576.81055 601.10480 612.0 0.001639 576.76941 599.22662 630.0 0.001587 576.72821 599.00519 641.0 0.001562 576.68701 600.27765 646.0 0.001550 576.64569 602.81091 636.0 0.001575 576.60431 606.29407 628.0 0.001587 576.56287 610.33618 625.0 0.001600 576.52136 614.45435 628.0 0.001587 576.47980 618.17303 635.0 0.001575 576.43817 620.96936 636.0 0.001575 576.39648 622.79169 631.0 0.001587 576.35468 623.82324 616.0 0.001626 576.31287 624.34344 606.0 0.001652 576.27100 624.40839 598.0 0.001666 576.22900 623.83881 610.0 0.001639 576.18695 622.32922 623.0 0.001600 576.14490 619.71930 637.0 0.001575 576.10272 616.19861 632.0 0.001587 576.06049 612.23132 621.0 0.001613 576.01819 608.32520 609.0 0.001639 575.97583 604.88995 604.0 0.001652 575.93341 602.21082 608.0 0.001639 575.89093 600.47028 599.0 0.001666 575.84839 599.77014 589.0 0.001694 575.80579 600.18518 605.0 0.001652 575.76306 601.69666 627.0 0.001600 575.72034 604.37976 657.0 0.001526 575.67749 608.29535 659.0 0.001514 575.63464 613.81470 657.0 0.001526 575.59167 621.31201 656.0 0.001526 575.54865 631.45996 659.0 0.001514 575.50555 645.20300 667.0 0.001502 575.46240 663.79572 676.0 0.001479 575.41919 688.56769 695.0 0.001435 575.37592 720.74225 744.0 0.001342 575.33252 760.74371 805.0 0.001240 575.28912 807.72217 876.0 0.001141 575.24561 859.12769 974.0 0.001027 575.20209 910.39746 1073.0 0.000930 575.15845 954.85583 1166.0 0.000860 575.11475 984.41547 1199.0 0.000835 575.07098 992.11053 1202.0 0.000831 575.02716 975.81799 1096.0 0.000913 574.98328 939.63562 996.0 0.001001 574.93933 891.35211 907.0 0.001104 574.89532 838.77789 832.0 0.001206 574.85120 788.00891 765.0 0.001303 574.80707 743.11383 712.0 0.001403 574.76282 706.36731 677.0 0.001479 574.71857 678.50946 668.0 0.001502 574.67419 659.34021 647.0 0.001550 574.62976 647.92432 628.0 0.001587 574.58527 643.12305 645.0 0.001550 574.54071 643.85681 663.0 0.001514 574.49603 649.24921 681.0 0.001468 574.45135 658.62689 682.0 0.001468 574.40656 671.43311 682.0 0.001468 574.36176 687.19458 699.0 0.001435 574.31683 705.47296 731.0 0.001372 574.27185 725.84729 778.0 0.001285 574.22687 747.54065 821.0 0.001214 574.18170 768.85284 862.0 0.001157 574.13654 786.98907 901.0 0.001111 574.09131 798.31433 899.0 0.001111 574.04602 799.56049 866.0 0.001157 574.00061 789.66101 834.0 0.001197 573.95514 770.57025 796.0 0.001257 573.90967 746.01355 738.0 0.001352 573.86407 719.76843 692.0 0.001446 573.81842 694.73132 652.0 0.001538 573.77271 672.74707 630.0 0.001587 573.72693 654.70953 618.0 0.001613 573.68103 640.72736 625.0 0.001600 573.63513 630.35815 619.0 0.001613 573.58911 622.96088 606.0 0.001652 573.54303 617.76770 600.0 0.001666 573.49689 614.28137 603.0 0.001652 573.45068 612.04840 622.0 0.001613 573.40442 610.65302 628.0 0.001587 573.35809 609.69891 626.0 0.001600 573.31171 608.85419 584.0 0.001708 573.26520 607.94598 567.0 0.001765 573.21863 607.08417 586.0 0.001708 573.17206 606.48505 612.0 0.001639 573.12537 606.39838 635.0 0.001575 573.07861 606.93640 601.0 0.001666 573.03174 608.03412 593.0 0.001680 572.98486 609.43536 615.0 0.001626 572.93793 610.70367 625.0 0.001600 572.89087 611.30957 629.0 0.001587 572.84375 610.83331 612.0 0.001639 572.79663 609.14563 600.0 0.001666 572.74939 606.62817 593.0 0.001680 572.70203 603.65210 593.0 0.001680 572.65466 600.57898 597.0 0.001680 572.60724 597.62781 609.0 0.001639 572.55969 594.88452 600.0 0.001666 572.51208 592.35968 572.0 0.001751 572.46442 590.09027 566.0 0.001765 572.41675 588.07074 564.0 0.001780 572.36890 586.38025 568.0 0.001765 572.32104 585.06122 585.0 0.001708 572.27307 584.13873 609.0 0.001639 572.22510 583.62933 580.0 0.001722 572.17700 583.54565 562.0 0.001780 572.12885 583.89355 580.0 0.001722 572.08063 584.67529 585.0 0.001708 572.03235 585.87799 583.0 0.001722 571.98401 587.51367 600.0 0.001666 571.93555 589.55042 609.0 0.001639 571.88702 591.95038 603.0 0.001652 571.83844 594.65588 593.0 0.001680 571.78979 597.60583 584.0 0.001708 571.74109 600.76398 605.0 0.001652 571.69232 604.31281 619.0 0.001613 571.64343 608.50812 622.0 0.001613 571.59454 613.65887 608.0 0.001639 571.54553 619.91290 591.0 0.001694 571.49646 627.12323 599.0 0.001666 571.44733 634.76929 620.0 0.001613 571.39813 641.92902 656.0 0.001526 571.34882 647.33118 648.0 0.001538 571.29944 649.65240 629.0 0.001587 571.25006 648.11206 611.0 0.001639 571.20056 642.95337 607.0 0.001652 571.15100 635.27777 619.0 0.001613 571.10138 626.45398 614.0 0.001626 571.05164 617.68048 605.0 0.001652 571.00189 609.84058 593.0 0.001680 570.95203 603.50409 588.0 0.001708 570.90210 599.02002 590.0 0.001694 570.85205 596.48315 588.0 0.001708 570.80200 595.84399 586.0 0.001708 570.75189 596.90137 590.0 0.001694 570.70166 599.38049 589.0 0.001694 570.65137 602.91833 586.0 0.001708 570.60101 607.07098 576.0 0.001736 570.55060 611.30646 571.0 0.001751 570.50012 615.05133 579.0 0.001722 570.44952 617.46619 584.0 0.001708 570.39886 619.24768 587.0 0.001708 570.34814 620.27875 589.0 0.001694 570.29736 620.86096 602.0 0.001666 570.24652 621.21716 635.0 0.001575 570.19562 621.24005 652.0 0.001538 570.14459 620.54340 660.0 0.001514 570.09351 618.65436 624.0 0.001600 570.04236 615.33582 595.0 0.001680 569.99115 610.79315 573.0 0.001751 569.93988 605.55823 575.0 0.001736 569.88849 600.21930 582.0 0.001722 569.83704 595.25562 579.0 0.001722 569.78552 591.00214 570.0 0.001751 569.73395 587.66443 554.0 0.001811 569.68231 585.34052 552.0 0.001811 569.63055 584.00555 553.0 0.001811 569.57874 583.65869 548.0 0.001826 569.52692 584.14874 551.0 0.001811 569.47498 585.32727 562.0 0.001780 569.42291 586.97156 573.0 0.001751 569.37085 588.86267 583.0 0.001722 569.31866 590.73560 584.0 0.001708 569.26642 592.12451 586.0 0.001708 569.21411 593.25641 588.0 0.001708 569.16174 593.94788 588.0 0.001708 569.10925 594.41370 589.0 0.001694 569.05676 594.94537 591.0 0.001694 569.00415 595.70813 575.0 0.001736 568.95148 596.75830 547.0 0.001826 568.89868 597.95941 548.0 0.001826 568.84589 599.00537 555.0 0.001795 568.79297 599.48419 570.0 0.001751 568.73999 599.04230 566.0 0.001765 568.68695 597.59088 552.0 0.001811 568.63385 595.37439 560.0 0.001780 568.58063 592.83289 573.0 0.001751 568.52734 590.43756 593.0 0.001680 568.47400 588.61115 581.0 0.001722 568.42059 587.71478 555.0 0.001795 568.36713 588.04926 543.0 0.001842 568.31354 589.84143 540.0 0.001858 568.25989 593.22540 550.0 0.001811 568.20618 598.20575 536.0 0.001858 568.15240 604.62799 521.0 0.001924 568.09857 612.11676 572.0 0.001751 568.04462 620.07343 595.0 0.001680 567.99060 627.62817 583.0 0.001722 567.93652 633.67236 595.0 0.001680 567.88232 637.08307 607.0 0.001652 567.82813 637.19464 580.0 . . . _pd_meas_number_of_points 5495 _pd_proc_number_of_points 5495 loop_ _refln_index_h _refln_index_k _refln_index_l _pd_refln_wavelength_id _refln_observed_status _refln_F_squared_meas _refln_F_squared_calc _refln_phase_calc _refln_d_spacing _gsas_i100_meas 1 1 1 1 o 2041.599 3854.287 180.00 8.86106 0.62 1 1 1 2 o 2101.387 3854.287 180.00 8.86106 0.32 2 0 0 1 o 1901.166 749.016 180.00 7.67391 0.42 2 0 0 2 o 1751.697 749.016 180.00 7.67391 0.19 2 1 0 1 o 23500.852 23455.566 0.00 6.86375 8.32 2 1 0 2 o 23297.826 23455.566 0.00 6.86375 4.10 2 1 1 1 o 233.852 200.602 0.00 6.26572 0.20 2 1 1 2 o 379.392 200.602 0.00 6.26572 0.14 2 2 0 1 o 4411.166 409.884 0.00 5.42627 1.02 2 2 0 2 o 4392.348 409.884 0.00 5.42627 0.51 2 2 1 1 o 5188.140 2932.652 180.00 5.11594 2.06 2 2 1 2 o 4820.240 2932.652 180.00 5.11594 0.95 3 1 1 1 o 20410.916 22114.697 0.00 4.62754 6.16 3 1 1 2 o 20531.641 22114.697 0.00 4.62754 3.09 2 2 2 1 o 516.428 224.244 180.00 4.43053 0.05 2 2 2 2 o 705.166 224.244 180.00 4.43053 0.03 3 0 2 1 o 71156.01 67911.22 0.00 4.25672 9.53 3 0 2 2 o 69274.74 67911.22 0.00 4.25672 4.61 3 1 2 1 o 11516.031 12666.746 180.00 4.10187 3.03 3 2 1 1 o 481.960 546.050 0.00 4.10187 0.17 3 2 1 2 o 444.203 546.050 0.00 4.10187 0.08 3 1 2 2 o 10838.129 12666.746 180.00 4.10187 1.42 4 0 0 1 o 18496.400 37677.23 180.00 3.83695 1.02 4 0 0 2 o 19138.170 37677.23 180.00 3.83695 0.53 3 2 2 1 o 2580.650 2364.132 0.00 3.72239 0.53 4 1 0 1 o 6396.752 5873.429 0.00 3.72239 0.64 3 2 2 2 o 2503.273 2364.132 0.00 3.72239 0.26 4 1 0 2 o 6209.731 5873.429 0.00 3.72239 0.31 4 1 1 1 o -7.818 1058.930 180.00 3.61751 0.00 4 1 1 2 o -7.818 1058.930 180.00 3.61751 0.00 3 3 1 1 o 29375.438 26784.342 180.00 3.52103 5.12 3 3 1 2 o 31335.203 26784.342 180.00 3.52103 2.72 4 0 2 1 o 221.673 666.092 0.00 3.43187 0.02 4 2 0 1 o 1273.925 4014.438 0.00 3.43187 0.11 4 2 0 2 o 359.292 4014.438 0.00 3.43187 0.02 4 0 2 2 o 73.350 666.092 0.00 3.43187 0.00 4 1 2 1 o 3636.547 3025.016 0.00 3.34917 0.61 4 2 1 1 o 37660.47 31552.826 180.00 3.34917 6.08 4 1 2 2 o 3664.436 3025.016 0.00 3.34917 0.30 4 2 1 2 o 37939.03 31552.826 180.00 3.34917 3.04 3 3 2 1 o 5416.869 3448.768 0.00 3.27216 0.78 3 3 2 2 o 5294.723 3448.768 0.00 3.27216 0.38 4 2 2 1 o 8756.289 8421.077 180.00 3.13286 1.22 4 2 2 2 o 12590.028 8421.077 180.00 3.13286 0.87 4 3 0 1 o 36662.02 41327.29 0.00 3.06956 2.49 4 3 0 2 o 32281.580 41327.29 0.00 3.06956 1.09 4 3 1 1 o 7976.838 9380.048 0.00 3.00995 1.02 4 1 3 1 o 1001.970 1188.494 0.00 3.00995 0.14 4 1 3 2 o 1386.649 1188.494 0.00 3.00995 0.09 4 3 1 2 o 10870.752 9380.048 0.00 3.00995 0.69 5 1 1 1 o 5243.474 4639.861 0.00 2.95369 0.57 3 3 3 1 o 40410.79 35266.00 0.00 2.95369 1.62 3 3 3 2 o 43498.36 35266.00 0.00 2.95369 0.87 5 1 1 2 o 5605.727 4639.861 0.00 2.95369 0.30 4 2 3 1 o 6874.817 4493.319 180.00 2.85002 0.77 4 3 2 1 o 205.904 137.345 0.00 2.85002 0.02 5 0 2 1 o 124945.90 80954.21 180.00 2.85002 7.12 4 3 2 2 o 183.429 137.345 0.00 2.85002 0.01 4 2 3 2 o 6094.119 4493.319 180.00 2.85002 0.34 5 0 2 2 o 110524.66 80954.21 180.00 2.85002 3.14 5 1 2 1 o 19622.600 17412.355 180.00 2.80211 2.27 5 2 1 1 o 9913.183 8797.513 180.00 2.80211 1.15 5 1 2 2 o 19282.939 17412.355 180.00 2.80211 1.11 5 2 1 2 o 9741.736 8797.513 180.00 2.80211 0.56 4 4 0 1 o 1907510.8 1936933.4 0.00 2.71314 100.00 4 4 0 2 o 1898930.3 1936933.4 0.00 2.71314 49.51 4 4 1 1 o -7.404 2.727 0.00 2.67171 0.01 5 2 2 1 o 3451.861 3831.234 180.00 2.67171 0.35 4 4 1 2 o -3.736 2.727 0.00 2.67171 0.00 5 2 2 2 o 3589.208 3831.234 180.00 2.67171 0.18 4 3 3 1 o 754.979 527.624 180.00 2.63213 0.07 4 3 3 2 o 1232.814 527.624 180.00 2.63213 0.06 5 3 1 1 o 10070.239 14609.412 180.00 2.59425 0.84 5 1 3 1 o 11946.205 17381.656 180.00 2.59425 1.01 5 3 1 2 o 11186.118 14609.412 180.00 2.59425 0.47 5 1 3 2 o 13282.417 17381.656 180.00 2.59425 0.56 4 4 2 1 o 1280.737 4456.591 180.00 2.55797 0.11 6 0 0 1 o 8797.235 31266.492 0.00 2.55797 0.20 6 0 0 2 o 19830.646 31266.492 0.00 2.55797 0.22 4 4 2 2 o 2840.223 4456.591 180.00 2.55797 0.12 6 1 0 1 o -138.780 1134.444 0.00 2.52316 0.00 6 1 0 2 o -138.780 1134.444 0.00 2.52316 0.00 5 2 3 1 o 311.446 275.230 180.00 2.48974 0.03 6 1 1 1 o 10891.653 9690.108 0.00 2.48974 0.87 5 3 2 1 o 26839.063 23830.656 0.00 2.48974 2.18 6 1 1 2 o 12080.793 9690.108 0.00 2.48974 0.48 5 3 2 2 o 29816.410 23830.656 0.00 2.48974 1.21 5 2 3 2 o 347.288 275.230 180.00 2.48974 0.01 6 2 0 1 o 39144.71 26420.877 0.00 2.42670 1.58 6 0 2 1 o 11848.800 7931.042 0.00 2.42670 0.49 6 0 2 2 o 10978.926 7931.042 0.00 2.42670 0.22 6 2 0 2 o 36319.60 26420.877 0.00 2.42670 0.73 5 0 4 1 o 38048.38 40303.44 180.00 2.39693 1.49 6 1 2 1 o 277.310 296.899 180.00 2.39693 0.03 4 4 3 1 o 7242.682 7666.311 180.00 2.39693 0.56 6 2 1 1 o 24952.988 26429.604 180.00 2.39693 1.95 6 2 1 2 o 24006.836 26429.604 180.00 2.39693 0.94 5 0 4 2 o 36603.46 40303.44 180.00 2.39693 0.71 4 4 3 2 o 6971.242 7666.311 180.00 2.39693 0.27 6 1 2 2 o 264.758 296.899 180.00 2.39693 0.01 5 1 4 1 o 4680.220 3835.405 0.00 2.36822 0.35 5 4 1 1 o 428.578 352.522 0.00 2.36822 0.03 5 1 4 2 o 4220.852 3835.405 0.00 2.36822 0.16 5 4 1 2 o 387.222 352.522 0.00 2.36822 0.01 5 3 3 1 o 5135.820 3522.180 0.00 2.34052 0.35 5 3 3 2 o 6276.355 3522.180 0.00 2.34052 0.21 6 2 2 1 o 1459.235 626.043 180.00 2.31377 0.10 6 2 2 2 o 1073.289 626.043 180.00 2.31377 0.04 5 4 2 1 o 1987.275 2237.919 180.00 2.28792 0.15 6 3 0 1 o 43158.70 48097.20 180.00 2.28792 1.49 5 2 4 1 o 197.414 224.261 0.00 2.28792 0.02 6 3 0 2 o 45696.88 48097.20 180.00 2.28792 0.78 5 4 2 2 o 2116.095 2237.919 180.00 2.28792 0.08 5 2 4 2 o 211.212 224.261 0.00 2.28792 0.01 6 3 1 1 o 207.530 779.708 0.00 2.26291 0.03 6 1 3 1 o 1521.730 4655.478 180.00 2.26291 0.14 6 3 1 2 o -55.035 779.708 0.00 2.26291 0.00 6 1 3 2 o 83.694 4655.478 180.00 2.26291 0.02 4 4 4 1 o 687753.0 684182.3 180.00 2.21527 14.69 4 4 4 2 o 685412.8 684182.3 180.00 2.21527 7.28 6 2 3 1 o 504.236 142.039 0.00 2.19254 0.03 6 3 2 1 o 265.159 67.889 0.00 2.19254 0.02 6 3 2 2 o 316.942 67.889 0.00 2.19254 0.01 6 2 3 2 o 599.313 142.039 0.00 2.19254 0.02 5 4 3 1 o -7.982 6.112 0.00 2.17051 0.00 5 3 4 1 o -2.059 464.379 0.00 2.17051 0.00 5 3 4 2 o 748.631 464.379 0.00 2.17051 0.02 5 4 3 2 o 14.700 6.112 0.00 2.17051 0.00 5 5 1 1 o 6.839 7.412 180.00 2.14912 0.00 7 1 1 1 o 19116.775 20218.258 180.00 2.14912 1.11 5 5 1 2 o 4.572 7.412 180.00 2.14912 0.00 7 1 1 2 o 14756.938 20218.258 180.00 2.14912 0.42 6 4 0 1 o 2848.032 6833.693 0.00 2.12836 0.10 6 0 4 1 o 273.171 771.354 0.00 2.12836 0.01 6 0 4 2 o 450.582 771.354 0.00 2.12836 0.01 6 4 0 2 o 4267.387 6833.693 0.00 2.12836 0.07 6 1 4 1 o 30673.699 25422.199 0.00 2.10818 1.74 7 0 2 1 o 27795.314 23015.152 180.00 2.10818 0.79 6 4 1 1 o 14532.388 11960.463 0.00 2.10818 0.85 6 1 4 2 o 32213.104 25422.199 0.00 2.10818 0.91 6 4 1 2 o 15286.321 11960.463 0.00 2.10818 0.45 7 0 2 2 o 29196.568 23015.152 180.00 2.10818 0.41 7 2 1 1 o 17043.758 14018.036 0.00 2.08857 0.91 5 5 2 1 o 6591.194 5406.773 180.00 2.08857 0.36 7 1 2 1 o 90.551 60.412 0.00 2.08857 0.01 6 3 3 1 o 510.355 438.437 180.00 2.08857 0.02 6 3 3 2 o 744.669 438.437 180.00 2.08857 0.02 7 2 1 2 o 26901.691 14018.036 0.00 2.08857 0.73 5 5 2 2 o 10450.094 5406.773 180.00 2.08857 0.29 7 1 2 2 o 188.745 60.412 0.00 2.08857 0.01 6 4 2 1 o 19813.803 12545.494 0.00 2.05094 1.10 6 2 4 1 o 40424.77 25762.723 0.00 2.05094 2.22 6 2 4 2 o 39484.49 25762.723 0.00 2.05094 1.08 6 4 2 2 o 19347.682 12545.494 0.00 2.05094 0.53 7 2 2 1 o 379.038 434.381 0.00 2.03287 0.02 5 4 4 1 o 4335.762 4918.243 0.00 2.03287 0.23 5 4 4 2 o 2002.956 4918.243 0.00 2.03287 0.05 7 2 2 2 o 157.395 434.381 0.00 2.03287 0.01 5 5 3 1 o 1449.191 1259.646 0.00 1.99811 0.06 7 1 3 1 o 55930.27 46827.30 0.00 1.99811 2.79 7 3 1 1 o 53197.89 44545.06 0.00 1.99811 2.65 7 3 1 2 o 51250.71 44545.06 0.00 1.99811 1.27 5 5 3 2 o 1406.537 1259.646 0.00 1.99811 0.03 7 1 3 2 o 53881.82 46827.30 0.00 1.99811 1.33 6 3 4 1 o 80816.63 72395.96 0.00 1.96509 3.97 6 4 3 1 o 1850.924 1650.304 180.00 1.96509 0.09 6 5 0 1 o 273.480 245.426 0.00 1.96509 0.01 6 5 0 2 o 272.246 245.426 0.00 1.96509 0.00 6 3 4 2 o 80446.23 72395.96 0.00 1.96509 1.96 6 4 3 2 o 1842.099 1650.304 180.00 1.96509 0.05 6 5 1 1 o 5674.490 10135.226 180.00 1.94917 0.26 7 3 2 1 o 15.625 77.031 0.00 1.94917 0.00 7 2 3 1 o 651.011 1022.718 180.00 1.94917 0.02 6 1 5 1 o 950.896 1912.813 0.00 1.94917 0.06 6 5 1 2 o 4035.111 10135.226 180.00 1.94917 0.09 7 2 3 2 o 514.404 1022.718 180.00 1.94917 0.01 6 1 5 2 o 597.378 1912.813 0.00 1.94917 0.02 7 3 2 2 o -6.943 77.031 0.00 1.94917 0.00 8 0 0 1 o 2475656.0 2454345.8 0.00 1.91848 29.29 8 0 0 2 o 2454081.8 2454345.8 0.00 1.91848 14.44 6 2 5 1 o 3317.654 2113.717 180.00 1.90366 0.15 6 5 2 1 o 2056.836 1294.857 180.00 1.90366 0.10 8 1 0 1 o 57799.81 37113.89 180.00 1.90366 1.33 7 0 4 1 o 145.604 81.175 0.00 1.90366 0.00 7 0 4 2 o 154.687 81.175 0.00 1.90366 0.00 8 1 0 2 o 60716.00 37113.89 180.00 1.90366 0.69 6 2 5 2 o 3487.380 2113.717 180.00 1.90366 0.08 6 5 2 2 o 2164.256 1294.857 180.00 1.90366 0.05 8 1 1 1 o 64.431 54.131 0.00 1.88918 0.00 7 1 4 1 o 1838.717 1517.349 0.00 1.88918 0.08 7 4 1 1 o 1730.900 1434.542 0.00 1.88918 0.08 5 5 4 1 o 2541.273 2105.527 180.00 1.88918 0.11 5 5 4 2 o 2772.030 2105.527 180.00 1.88918 0.06 7 4 1 2 o 1887.842 1434.542 0.00 1.88918 0.04 7 1 4 2 o 2008.905 1517.349 0.00 1.88918 0.05 8 1 1 2 o 69.886 54.131 0.00 1.88918 0.00 7 3 3 1 o 68630.51 70783.81 180.00 1.87503 2.98 7 3 3 2 o 59987.05 70783.81 180.00 1.87503 1.30 8 0 2 1 o -5.583 30.766 0.00 1.86120 0.00 6 4 4 1 o 13.022 1393.933 0.00 1.86120 0.00 8 2 0 1 o -221.082 3528.122 0.00 1.86120 0.00 8 2 0 2 o 695.016 3528.122 0.00 1.86120 0.01 8 0 2 2 o 3.299 30.766 0.00 1.86120 0.00 6 4 4 2 o 350.440 1393.933 0.00 1.86120 0.01 7 2 4 1 o 12.153 14.474 0.00 1.84766 0.00 7 4 2 1 o 44703.63 54039.98 0.00 1.84766 1.89 8 1 2 1 o 14431.540 17576.709 0.00 1.84766 0.64 8 2 1 1 o 17562.529 21202.793 0.00 1.84766 0.74 7 2 4 2 o 11.659 14.474 0.00 1.84766 0.00 8 1 2 2 o 13762.416 17576.709 0.00 1.84766 0.30 8 2 1 2 o 16788.074 21202.793 0.00 1.84766 0.35 7 4 2 2 o 42717.35 54039.98 0.00 1.84766 0.90 6 5 3 1 o 4062.878 2453.833 0.00 1.83441 0.19 6 3 5 1 o 22046.559 14067.494 180.00 1.83441 0.94 6 3 5 2 o 23554.674 14067.494 180.00 1.83441 0.50 6 5 3 2 o 4367.004 2453.833 0.00 1.83441 0.10 6 6 0 1 o 54961.65 27538.262 0.00 1.80876 1.12 8 2 2 1 o 138.812 3.774 0.00 1.80876 0.01 8 2 2 2 o 72.232 3.774 0.00 1.80876 0.00 6 6 0 2 o 41440.71 27538.262 0.00 1.80876 0.42 8 3 0 2 o 6823.988 2282.166 180.00 1.79633 0.07 6 6 1 2 o 3499.725 1107.269 180.00 1.79633 0.07 8 3 0 1 o 6973.499 2282.166 180.00 1.79633 0.14 6 6 1 1 o 3578.484 1107.269 180.00 1.79633 0.14 8 1 3 1 o 12592.650 8747.005 0.00 1.78415 0.49 7 4 3 1 o 50.551 36.786 180.00 1.78415 0.00 8 3 1 1 o 9447.156 6565.452 180.00 1.78415 0.37 7 3 4 1 o 615.591 431.888 180.00 1.78415 0.02 7 3 4 2 o 396.715 431.888 180.00 1.78415 0.01 7 4 3 2 o 34.151 36.786 180.00 1.78415 0.00 8 1 3 2 o 8010.684 8747.005 0.00 1.78415 0.16 8 3 1 2 o 6013.697 6565.452 180.00 1.78415 0.12 7 1 5 1 o 1331.629 2775.282 0.00 1.77221 0.04 7 5 1 1 o 2005.785 4307.493 0.00 1.77221 0.06 5 5 5 1 o 8330.350 23869.887 180.00 1.77221 0.14 7 5 1 2 o 1642.698 4307.493 0.00 1.77221 0.02 7 1 5 2 o 1103.897 2775.282 0.00 1.77221 0.01 5 5 5 2 o 5879.033 23869.887 180.00 1.77221 0.05 6 6 2 1 o 131.288 55.608 0.00 1.76051 0.00 6 6 2 2 o 82.437 55.608 0.00 1.76051 0.00 8 2 3 1 o 29624.713 31265.467 0.00 1.74905 1.10 6 4 5 1 o 409.090 434.094 0.00 1.74905 0.02 8 3 2 1 o 6526.098 6905.536 180.00 1.74905 0.25 6 5 4 1 o 43280.60 45710.68 180.00 1.74905 1.63 6 4 5 2 o 406.681 434.094 0.00 1.74905 0.01 6 5 4 2 o 43046.43 45710.68 180.00 1.74905 0.80 8 3 2 2 o 6489.542 6905.536 180.00 1.74905 0.13 8 2 3 2 o 29466.602 31265.467 0.00 1.74905 0.54 7 2 5 1 o 2964.667 1363.146 0.00 1.73780 0.12 7 5 2 1 o 8426.389 4312.348 180.00 1.73780 0.32 7 5 2 2 o 9476.784 4312.348 180.00 1.73780 0.18 7 2 5 2 o 3373.565 1363.146 0.00 1.73780 0.07 8 0 4 1 o 46204.84 96511.91 180.00 1.71594 0.80 8 4 0 1 o 19650.865 41563.36 180.00 1.71594 0.35 8 4 0 2 o 17112.135 41563.36 180.00 1.71594 0.15 8 0 4 2 o 40376.39 96511.91 180.00 1.71594 0.35 8 1 4 1 o 18410.352 34858.582 0.00 1.70531 0.65 8 4 1 1 o 3063.116 5792.486 0.00 1.70531 0.11 6 6 3 1 o 1740.293 3413.974 0.00 1.70531 0.07 7 4 4 1 o 8885.487 17052.109 0.00 1.70531 0.32 8 4 1 2 o 2797.448 5792.486 0.00 1.70531 0.05 8 1 4 2 o 16809.338 34858.582 0.00 1.70531 0.30 6 6 3 2 o 1577.383 3413.974 0.00 1.70531 0.03 7 4 4 2 o 8090.583 17052.109 0.00 1.70531 0.15 8 3 3 1 o 414.620 704.796 0.00 1.69488 0.02 8 3 3 2 o -73.358 704.796 0.00 1.69488 0.00 9 1 1 1 o 4152.526 6692.008 0.00 1.68464 0.18 7 5 3 1 o 10898.798 15942.536 180.00 1.68464 0.35 7 3 5 1 o 12351.752 18089.896 180.00 1.68464 0.40 7 5 3 2 o 11626.639 15942.536 180.00 1.68464 0.19 9 1 1 2 o 4518.987 6692.008 0.00 1.68464 0.09 7 3 5 2 o 13179.799 18089.896 180.00 1.68464 0.21 8 4 2 1 o 2017.466 4264.565 180.00 1.67458 0.07 8 2 4 1 o 63.120 135.615 180.00 1.67458 0.00 8 2 4 2 o -6.556 135.615 180.00 1.67458 0.00 8 4 2 2 o -142.263 4264.565 180.00 1.67458 0.00 9 0 2 1 o 591.103 1104.821 180.00 1.66470 0.01 7 0 6 1 o 11491.075 19979.881 0.00 1.66470 0.19 7 0 6 2 o -108.983 19979.881 0.00 1.66470 0.00 9 0 2 2 o -110.899 1104.821 180.00 1.66470 0.00 7 6 1 1 o 4887.679 5461.026 180.00 1.65500 0.14 9 1 2 1 o 148.202 158.435 180.00 1.65500 0.00 7 1 6 1 o 766.642 858.167 0.00 1.65500 0.02 9 2 1 1 o 100.563 113.452 180.00 1.65500 0.00 6 5 5 1 o 3860.639 4445.065 180.00 1.65500 0.14 7 1 6 2 o 181.282 858.167 0.00 1.65500 0.00 7 6 1 2 o 1220.728 5461.026 180.00 1.65500 0.01 9 1 2 2 o 82.758 158.435 180.00 1.65500 0.00 9 2 1 2 o 18.127 113.452 180.00 1.65500 0.00 6 5 5 2 o 122.844 4445.065 180.00 1.65500 0.01 6 6 4 1 o 4010.149 4792.515 0.00 1.63608 0.14 6 6 4 2 o 2760.635 4792.515 0.00 1.63608 0.05 7 2 6 1 o 12442.271 16079.590 0.00 1.62686 0.40 7 6 2 1 o 8369.913 10762.546 0.00 1.62686 0.27 9 2 2 1 o 286.395 373.127 180.00 1.62686 0.01 8 4 3 1 o 4106.469 5299.691 0.00 1.62686 0.13 8 5 0 1 o 184.278 265.417 0.00 1.62686 0.00 8 3 4 1 o 19533.223 25201.141 0.00 1.62686 0.63 8 5 0 2 o 213.939 265.417 0.00 1.62686 0.00 8 4 3 2 o 4542.660 5299.691 0.00 1.62686 0.07 7 6 2 2 o 9244.557 10762.546 0.00 1.62686 0.15 7 2 6 2 o 13771.915 16079.590 0.00 1.62686 0.22 9 2 2 2 o 318.100 373.127 180.00 1.62686 0.01 8 3 4 2 o 21605.164 25201.141 0.00 1.62686 0.34 8 1 5 1 o 11604.149 9966.664 180.00 1.61780 0.36 7 4 5 1 o 1221.284 1041.027 0.00 1.61780 0.04 8 5 1 1 o 456.301 392.183 180.00 1.61780 0.01 7 5 4 1 o 4466.694 3838.333 0.00 1.61780 0.14 8 1 5 2 o 11282.773 9966.664 180.00 1.61780 0.17 7 5 4 2 o 4343.374 3838.333 0.00 1.61780 0.07 8 5 1 2 o 443.717 392.183 180.00 1.61780 0.01 7 4 5 2 o 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