#------------------------------------------------------------------------------ #$Date: 2025-07-01 13:39:59 +0300 (Tue, 01 Jul 2025) $ #$Revision: 1111 $ #$URL: svn://localhost/testcod/cif/7/20/00/7200023.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/ # # All data on this site have been placed in the public domain by the # contributors. # data_7200023 loop_ _publ_author_name 'Gu\'nka, Piotr A.' 'Hanfland, Michael' 'Chen, Yu-Sheng' 'Zachara, Janusz' _publ_section_title ; High-pressure and low-temperature structural study of claudetite I, a monoclinic layered As2O3 polymorph ; _journal_issue 3 _journal_name_full CrystEngComm _journal_page_first 638 _journal_page_last 644 _journal_paper_doi 10.1039/D0CE01401J _journal_volume 23 _journal_year 2021 _chemical_formula_moiety 'As2 O3' _chemical_formula_sum 'As2 O3' _chemical_formula_weight 197.84 _chemical_name_common 'claudetite I' _chemical_name_systematic ; arsenic(III) oxide ; _space_group_IT_number 14 _space_group_name_Hall '-P 2yn' _space_group_name_H-M_alt 'P 1 21/n 1' _symmetry_cell_setting monoclinic _symmetry_space_group_name_H-M 'P 1 21/n 1' _audit_creation_date 2020-10-21T10:59 _audit_creation_method 'created in GSAS-II' _audit_update_record ; 2020-10-22 deposited with the CCDC. 2020-12-10 downloaded from the CCDC. ; _cell_angle_alpha 90 _cell_angle_beta 94.364(4) _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 5.2690(4) _cell_length_b 12.82716(16) _cell_length_c 4.51254(30) _cell_measurement_pressure 5.4e5(5) _cell_measurement_temperature 293 _cell_volume 304.10(3) _computing_data_reduction Fit2D _computing_structure_refinement 'GSAS-II (Toby & Von Dreele, J. Appl. Cryst. 46, 544-549, 2013)' _diffrn_ambient_pressure 5.4e5(5) _diffrn_ambient_temperature 293 _diffrn_detector 'Mar555 flat panel' _diffrn_detector_type 'Mar555 flat panel' _diffrn_measurement_device_type 'ESRF ID09A beamline' _diffrn_radiation_monochromator Si _diffrn_radiation_polarisn_ratio 0.9900 _diffrn_radiation_probe x-ray _diffrn_radiation_wavelength 0.41421 _diffrn_source 'ESRF ID09A' _diffrn_source_type synchrotron _exptl_crystal_colour colourless _exptl_crystal_density_diffrn 4.3212 _exptl_crystal_description 'white powder' _pd_block_id 2020-10-21T10:59|clau1_003rietveld||id09b _pd_meas_number_of_points 4000 _pd_phase_name claudetiteI _pd_prep_pressure 100.0(1) _pd_prep_temperature 293 _pd_proc_ls_background_function ; Background function: "chebyschev" function with 30 terms: 782.8(6), 239.2(26), -1114(12), 5648(19), 6.191(5)e4, -278335(30), -1.28727(5)e6, 6.063937(16)e6, 1.483102(5)e7, -7.2912329(16)e7, -1.01039853(18)e8, 5.30395748(26)e8, 4.3281636(5)e8, -2.500318791(24)e9, -1.22014767(6)e9, 8.006860697(13)e9, 2.319376186(30)e9, -1.7915873546(12)e10, -2.980478975(19)e9, 2.8351649121(23)e10, 2.52825269(5)e9, -3.1628384839(30)e10, -1.32117156(7)e9, 2.4348018031(29)e10, 3.4919292(5)e8, -1.2316078086(16)e10, -8.761903(9)e6, 3.685288436(12)e9, -1.164285(10)e7, -4.9443567(5)e8, ; _pd_proc_ls_pref_orient_corr ; Simple spherical harmonic correction Order = 6 Coefficients: 0:0:C(4,4) = 0.528(18); 0:0:C(6,6) = 0.089(17); 0:0:C(6,-2) = -0.156(21); 0:0:C(2,-2) = -0.074(11); 0:0:C(4,-4) = -0.134(16); 0:0:C(2,2) = -0.263(11); 0:0:C(4,0) = 0.293(14); 0:0:C(6,-6) = 0.471(21); 0:0:C(6,4) = 0.323(23); 0:0:C(4,2) = -0.388(18); 0:0:C(6,2) = -0.241(20); 0:0:C(6,-4) = -0.055(20); 0:0:C(6,0) = -0.028(20); 0:0:C(2,0) = 0.816(13); 0:0:C(4,-2) = -0.402(16); ; _pd_proc_ls_profile_function ; Finger-Cox-Jephcoat function parameters U, V, W, X, Y, SH/L: peak variance(Gauss) = Utan(Th)^2^+Vtan(Th)+W: peak HW(Lorentz) = X/cos(Th)+Ytan(Th); SH/L = S/L+H/L U, V, W in (centideg)^2^, X & Y in centideg 53(30), -14(6), 1.95(28), 0.23(9), 21.3(26), 0.002, Crystallite size in microns with "isotropic" model: parameters: Size, G/L mix 1.000, 1.000, Microstrain, "isotropic" model (10^6^ * delta Q/Q) parameters: Mustrain, G/L mix 1000.000, 1.000, ; _pd_proc_ls_prof_R_factor 0.00660 _pd_proc_ls_prof_wR_expected 0.03477 _pd_proc_ls_prof_wR_factor 0.01017 _refine_ls_goodness_of_fit_all 0.299 _refine_ls_matrix_type full _refine_ls_number_parameters 72 _refine_ls_R_Fsqd_factor 0.09325 _refine_ls_shift/su_max 0.0004 _refine_ls_wR_factor_obs 0.01020 _reflns_d_resolution_high 1.202 _reflns_d_resolution_low 6.414 _reflns_limit_h_max 4 _reflns_limit_h_min 0 _reflns_limit_k_max 10 _reflns_limit_k_min 0 _reflns_limit_l_max 3 _reflns_limit_l_min -3 _reflns_number_total 183 _cod_data_source_file d0ce01401j3.cif _cod_data_source_block clau1_003rietveld _cod_original_cell_volume 304.104(11) _cod_database_code 7200023 _refine_ls_r_f_factor 0.04845 _gsas_proc_ls_prof_r_b_factor 0.01330 _gsas_proc_ls_prof_wr_b_factor 0.02634 loop_ _space_group_symop_id _space_group_symop_operation_xyz 1 x,y,z 2 1/2-x,1/2+y,1/2-z 3 -x,-y,-z 4 1/2+x,1/2-y,1/2+z loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy _atom_site_adp_type _atom_site_U_iso_or_equiv _atom_site_symmetry_multiplicity As1 As 0.2560(7) 0.09887(18) 0.0386(9) 1.000 Uiso 0.0011(12) 4 As2 As 0.3512(5) 0.35064(19) 0.0037(9) 1.000 Uiso 0.0011 4 O3 O 0.4211(18) 0.21889(31) 0.086(5) 1.000 Uiso 0.0011 4 O4 O 0.6565(11) 0.3876(10) 0.1564(13) 1.000 Uiso 0.0011 4 O5 O -0.0425(14) 0.1451(11) 0.1409(14) 1.000 Uiso 0.0011 4 loop_ _atom_type_symbol _atom_type_number_in_cell _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_length_neutron _atom_type_scat_source _atom_type_scat_dispersion_real _atom_type_scat_dispersion_imag _atom_type_scat_dispersion_source As 8 16.6723 6.0701 3.4313 4.2779 2.6345 0.2647 12.9479 47.7972 2.531 0.658 https://subversion.xray.aps.anl.gov/pyGSAS/trunk/atmdata.py 0.283 0.775 https://subversion.xray.aps.anl.gov/pyGSAS/trunk/atmdata.py O 12 3.0485 2.2868 1.5463 0.867 13.2771 5.7011 0.3239 32.9089 0.2508 0.5805 https://subversion.xray.aps.anl.gov/pyGSAS/trunk/atmdata.py 0.002 0.002 https://subversion.xray.aps.anl.gov/pyGSAS/trunk/atmdata.py 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 O3 As1 O4 98.0(8) 1_555 1_555 4_454 yes O3 As1 O5 96.6(7) 1_555 1_555 1_555 yes O4 As1 O5 91.0(4) 4_454 1_555 1_555 yes O3 As2 O4 90.3(4) 1_555 1_555 1_555 yes O3 As2 O5 98.6(10) 1_555 1_555 4_554 yes O4 As2 O5 90.6(4) 1_555 1_555 4_554 yes As1 O3 As2 135.5(4) 1_555 1_555 1_555 yes As1 O4 As2 126.8(5) 4_555 1_555 1_555 yes As1 O5 As2 126.8(4) 1_555 1_555 4_455 yes 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 As1 O3 1.7733(29) 1_555 1_555 yes As1 O4 1.7725(29) 1_555 4_454 yes As1 O5 1.7749(29) 1_555 1_555 yes As2 O3 1.7634(29) 1_555 1_555 yes As2 O4 1.7660(29) 1_555 1_555 yes As2 O5 1.7706(29) 1_555 4_554 yes loop_ _pd_meas_2theta_scan _pd_meas_intensity_total _pd_calc_intensity_total _pd_proc_intensity_bkg_calc _pd_proc_ls_weight 0.00440 110.88128 0 0 0 0.01321 112.02883 0 0 0 0.02202 113.08712 0 0 0 0.03083 109.97532 0 0 0 0.03963 107.50637 0 0 0 0.04844 105.31312 0 0 0 0.05725 105.37281 0 0 0 0.06605 104.3267 0 0 0 0.07486 104.59062 0 0 0 0.08367 104.16719 0 0 0 0.09248 104.85167 0 0 0 0.10128 104.63193 0 0 0 0.11009 104.52472 0 0 0 0.11890 104.90537 0 0 0 0.12770 105.54061 0 0 0 0.13651 105.61244 0 0 0 0.14532 104.21741 0 0 0 0.15413 105.15057 0 0 0 0.16293 105.43537 0 0 0 0.17174 106.50997 0 0 0 0.18055 106.20427 0 0 0 0.18935 106.298 0 0 0 0.19816 106.12174 0 0 0 0.20697 106.12741 0 0 0 0.21578 105.31084 0 0 0 0.22458 105.50249 0 0 0 0.23339 105.95099 0 0 0 0.24220 107.08839 0 0 0 0.25100 108.15091 0 0 0 0.25981 108.89423 0 0 0 0.26862 111.15749 0 0 0 0.27743 115.63641 0 0 0 0.28623 117.59696 0 0 0 0.29504 116.4302 0 0 0 0.30385 114.6059 0 0 0 0.31265 112.38779 0 0 0 0.32146 111.54327 0 0 0 0.33027 111.78263 0 0 0 0.33908 112.20147 0 0 0 0.34788 112.03135 0 0 0 0.35669 111.54203 0 0 0 0.36550 110.15353 0 0 0 0.37430 110.05855 0 0 0 0.38311 109.86495 0 0 0 0.39192 111.04333 0 0 0 0.40073 111.5141 0 0 0 0.40953 112.9538 0 0 0 0.41834 114.35498 0 0 0 0.42715 114.35748 0 0 0 0.43595 114.10443 0 0 0 0.44476 113.83931 0 0 0 0.45357 114.01981 0 0 0 0.46238 113.85059 0 0 0 0.47118 112.17596 0 0 0 0.47999 110.50166 0 0 0 0.48880 110.48582 0 0 0 0.49760 110.61709 0 0 0 0.50641 111.76645 0 0 0 0.51522 112.70025 0 0 0 0.52403 113.31376 0 0 0 0.53283 112.61272 0 0 0 0.54164 111.75623 0 0 0 0.55045 111.86808 0 0 0 0.55925 112.70805 0 0 0 0.56806 113.25793 0 0 0 0.57687 112.07762 0 0 0 0.58568 111.89946 0 0 0 0.59448 111.69861 0 0 0 0.60329 112.24815 0 0 0 0.61210 112.46396 0 0 0 0.62091 112.63622 0 0 0 0.62971 112.33858 0 0 0 0.63852 112.02351 0 0 0 0.64733 110.99883 0 0 0 0.65613 110.32499 0 0 0 0.66494 110.73078 0 0 0 0.67375 112.08038 0 0 0 0.68256 112.65051 0 0 0 0.69136 112.82188 0 0 0 0.70017 112.87254 0 0 0 0.70898 113.53629 0 0 0 0.71778 114.0345 0 0 0 0.72659 114.43555 0 0 0 0.73540 114.0812 0 0 0 0.74421 113.27271 0 0 0 0.75301 113.36128 0 0 0 0.76182 113.31378 0 0 0 0.77063 113.30617 0 0 0 0.77943 113.00538 0 0 0 0.78824 114.07462 0 0 0 0.79705 113.52671 0 0 0 0.80586 113.56056 0 0 0 0.81466 113.86357 0 0 0 0.82347 114.41327 0 0 0 0.83228 113.62103 0 0 0 0.84108 113.89872 0 0 0 0.84989 114.02803 0 0 0 0.85870 115.28915 0 0 0 0.86751 115.67013 0 0 0 0.87631 116.55635 0 0 0 0.88512 117.19505 0 0 0 0.89393 119.01133 0 0 0 0.90273 120.02425 0 0 0 0.91154 121.30619 0 0 0 0.92035 121.94592 0 0 0 0.92916 122.73228 0 0 0 0.93796 124.86527 0 0 0 0.94677 126.9808 0 0 0 0.95558 129.5453 0 0 0 0.96438 129.61469 0 0 0 0.97319 130.59406 0 0 0 0.98200 131.22807 0 0 0 0.99081 134.42601 0 0 0 0.99961 138.91035 0 0 0 1.00842 142.22159 0 0 0 1.01723 146.34416 0 0 0 1.02603 151.04527 0 0 0 1.03484 160.28993 0 0 0 1.04365 168.4823 0 0 0 1.05246 178.25523 0 0 0 1.06126 184.81668 0 0 0 1.07007 197.17075 0 0 0 1.07888 203.57504 0 0 0 1.08768 209.57251 0 0 0 1.09649 213.88902 0 0 0 1.10530 218.76981 0 0 0 1.11411 225.05948 0 0 0 1.12291 230.94792 0 0 0 1.13172 237.80217 0 0 0 1.14053 243.50113 0 0 0 1.14933 247.26175 0 0 0 1.15814 249.33064 0 0 0 1.16695 250.75069 0 0 0 1.17576 252.82367 0 0 0 1.18456 255.02449 0 0 0 1.19337 257.37665 0 0 0 1.20218 259.07526 0 0 0 1.21099 261.16077 0 0 0 1.21979 263.74875 0 0 0 1.22860 265.8522 0 0 0 1.23741 268.28882 0 0 0 1.24621 270.18137 0 0 0 1.25502 271.62695 0 0 0 1.26383 272.63379 0 0 0 1.27264 274.57861 0 0 0 1.28144 276.88559 0 0 0 1.29025 280.70963 0 0 0 1.29906 283.00305 0 0 0 1.30786 285.11856 0 0 0 1.31667 286.60947 0 0 0 1.32548 288.05167 0 0 0 1.33429 289.45844 0 0 0 1.34309 290.03122 0 0 0 1.35190 291.17981 0 0 0 1.36071 291.93701 0 0 0 1.36951 293.09332 0 0 0 1.37832 294.13049 0 0 0 1.38713 296.27655 0 0 0 1.39594 298.41171 0 0 0 1.40474 299.58063 0 0 0 1.41355 299.73169 0 0 0 1.42236 300.89734 0 0 0 1.43116 302.284 0 0 0 1.43997 305.25125 0 0 0 1.44878 306.93958 0 0 0 1.45759 306.65793 0 0 0 1.46639 306.33548 0 0 0 1.47520 308.35959 0 0 0 1.48401 310.5368 0 0 0 1.49281 312.36249 0 0 0 1.50162 314.05984 0 0 0 1.51043 314.61627 0 0 0 1.51924 315.06305 0 0 0 1.52804 315.74063 0 0 0 1.53685 316.77167 0 0 0 1.54566 318.29202 0 0 0 1.55446 319.18631 0 0 0 1.56327 319.56799 0 0 0 1.57208 318.94604 0 0 0 1.58089 319.15359 0 0 0 1.58969 320.21069 0 0 0 1.59850 322.31592 0 0 0 1.60731 323.15485 0 0 0 1.61611 324.47812 0 0 0 1.62492 325.04819 0 0 0 1.63373 326.28757 0 0 0 1.64254 328.09564 0 0 0 1.65134 328.29193 0 0 0 1.66015 329.31677 0 0 0 1.66896 329.70172 0 0 0 1.67776 330.55115 0 0 0 1.68657 330.99637 0 0 0 1.69538 332.91721 0 0 0 1.70419 334.30759 0 0 0 1.71299 334.30527 0 0 0 1.72180 334.51968 0 0 0 1.73061 335.53363 0 0 0 1.73941 336.19257 0 0 0 1.74822 336.72153 0 0 0 1.75703 337.32364 0 0 0 1.76584 338.45547 0 0 0 1.77464 339.21606 0 0 0 1.78345 340.33035 0 0 0 1.79226 341.3172 0 0 0 1.80107 342.65817 0 0 0 1.80987 343.13992 0 0 0 1.81868 343.38074 0 0 0 1.82749 345.3212 0 0 0 1.83629 345.74512 0 0 0 1.84510 346.14026 0 0 0 1.85391 346.37305 0 0 0 1.86272 348.29318 0 0 0 1.87152 349.1572 0 0 0 1.88033 349.40631 0 0 0 1.88914 348.95847 0 0 0 1.89794 349.58771 0 0 0 1.90675 350.39581 0 0 0 1.91556 351.74005 0 0 0 1.92437 352.47546 0 0 0 1.93317 352.9541 0 0 0 1.94198 352.66104 0 0 0 1.95079 353.27289 0 0 0 1.95959 355.2175 0 0 0 1.96840 356.46735 0 0 0 1.97721 356.41141 0 0 0 1.98602 356.49191 0 0 0 1.99482 357.7706 0 0 0 2.00363 359.3584 0 0 0 2.01244 359.70142 0 0 0 2.02124 359.53613 0 0 0 2.03005 359.37241 0 0 0 2.03886 360.02264 0 0 0 2.04767 360.67282 0 0 0 2.05647 361.73648 0 0 0 2.06528 362.13596 0 0 0 2.07409 362.78595 0 0 0 2.08289 363.77603 0 0 0 2.09170 364.45474 0 0 0 2.10051 364.74542 0 0 0 2.10932 366.26508 0 0 0 2.11812 366.00391 0 0 0 2.12693 366.53897 0 0 0 2.13574 367.28528 0 0 0 2.14454 369.52411 0 0 0 2.15335 370.16019 0 0 0 2.16216 370.38956 0 0 0 2.17097 370.42459 0 0 0 2.17977 371.12857 0 0 0 2.18858 371.37561 0 0 0 2.19739 371.70407 0 0 0 2.20619 372.12518 0 0 0 2.21500 372.31592 0 0 0 2.22381 373.46457 0 0 0 2.23262 373.67413 0 0 0 2.24142 373.79495 0 0 0 2.25023 373.85938 0 0 0 2.25904 375.1109 0 0 0 2.26784 376.59897 0 0 0 2.27665 377.48788 0 0 0 2.28546 377.52582 0 0 0 2.29427 377.70941 0 0 0 2.30307 378.52609 0 0 0 2.31188 379.51022 0 0 0 2.32069 380.08948 0 0 0 2.32950 379.29855 0 0 0 2.33830 378.57925 0 0 0 2.34711 379.41354 0 0 0 2.35592 380.46747 0 0 0 2.36472 381.42624 0 0 0 2.37353 382.29211 0 0 0 2.38234 383.17349 0 0 0 2.39115 384.0141 0 0 0 2.39995 384.50104 0 0 0 2.40876 384.78876 0 0 0 2.41757 385.565 0 0 0 2.42637 385.94586 0 0 0 2.43518 386.52118 0 0 0 2.44399 386.64359 0 0 0 2.45280 386.22476 0 0 0 2.46160 386.28857 0 0 0 2.47041 387.81384 0 0 0 2.47922 388.25281 0 0 0 2.48802 388.13519 0 0 0 2.49683 388.36264 0 0 0 2.50564 389.44662 0 0 0 2.51445 390.60849 0 0 0 2.52325 391.29822 0 0 0 2.53206 391.38925 0 0 0 2.54087 391.66281 0 0 0 2.54967 392.01404 0 0 0 2.55848 393.04919 0 0 0 2.56729 394.16702 0 0 0 2.57610 395.35596 0 0 0 2.58490 395.91742 0 0 0 2.59371 396.16653 0 0 0 2.60252 395.76749 0 0 0 2.61132 395.54599 0 0 0 2.62013 395.98434 0 0 0 2.62894 396.64883 0 0 0 2.63775 397.44601 0 0 0 2.64655 398.04062 0 0 0 2.65536 398.21484 0 0 0 2.66417 398.77112 0 0 0 2.67297 398.94467 0 0 0 2.68178 398.79913 0 0 0 2.69059 399.82718 0 0 0 2.69940 400.48788 0 0 0 2.70820 401.3952 0 0 0 2.71701 401.69553 0 0 0 2.72582 401.80228 0 0 0 2.73462 402.12128 0 0 0 2.74343 403.60269 0 0 0 2.75224 404.77658 0 0 0 2.76105 404.56622 0 0 0 2.76985 404.28513 0 0 0 2.77866 404.07458 0 0 0 2.78747 403.79422 0 0 0 2.79627 404.46985 0 0 0 2.80508 405.7822 0 0 0 2.81389 406.71545 0 0 0 2.82270 406.92807 0 0 0 2.83150 407.30313 0 0 0 2.84031 408.72272 0 0 0 2.84912 409.16071 0 0 0 2.85792 408.98846 0 0 0 2.86673 409.20547 0 0 0 2.87554 410.45685 0 0 0 2.88435 411.84583 0 0 0 2.89315 412.34714 0 0 0 2.90196 411.79822 0 0 0 2.91077 411.50671 0 0 0 2.91958 412.25235 413.242127 413.186088 0.002425699 2.92838 412.81885 414.04215 413.985073 0.00242237 2.93719 412.95346 414.768733 414.710585 0.00242158 2.94600 413.95004 415.426202 415.366948 0.00241575 2.95480 415.25439 416.019425 415.959031 0.002408162 2.96361 416.55038 416.553702 416.49213 0.00240067 2.97242 416.91263 417.034596 416.971807 0.002398584 2.98123 417.17743 417.467831 417.403784 0.002397062 2.99003 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193.12267 0 0 0 34.48445 194.39417 0 0 0 34.49326 194.74664 0 0 0 34.50207 192.06732 0 0 0 34.51088 201.84755 0 0 0 34.51968 210.7634 0 0 0 34.52849 216.19273 0 0 0 34.53730 208.34375 0 0 0 34.54610 189.29819 0 0 0 34.55491 185.52542 0 0 0 34.56372 186.05206 0 0 0 34.57252 190.34494 0 0 0 34.58133 199.15727 0 0 0 34.59014 200.35292 0 0 0 34.59895 207.12006 0 0 0 34.60775 212.01988 0 0 0 34.61656 207.59952 0 0 0 34.62537 204.04329 0 0 0 34.63418 204.69685 0 0 0 34.64298 202.15265 0 0 0 34.65179 203.30737 0 0 0 34.66060 206.95755 0 0 0 34.66941 202.20352 0 0 0 34.67821 203.13841 0 0 0 34.68702 197.45775 0 0 0 34.69583 188.50352 0 0 0 34.70463 203.35753 0 0 0 34.71344 209.34818 0 0 0 34.72225 219.92723 0 0 0 34.73106 218.23357 0 0 0 34.73986 209.64491 0 0 0 34.74867 209.51912 0 0 0 34.75748 209.00542 0 0 0 34.76629 225.57745 0 0 0 34.77509 229.01886 0 0 0 34.78390 216.14722 0 0 0 34.79271 221.68576 0 0 0 34.80151 223.24028 0 0 0 34.81032 222.76186 0 0 0 34.81913 225.55931 0 0 0 34.82793 226.61578 0 0 0 34.83674 210.11435 0 0 0 34.84555 201.74106 0 0 0 34.85435 213.24474 0 0 0 34.86316 220.6891 0 0 0 34.87197 225.84755 0 0 0 34.88077 225.77205 0 0 0 34.88958 238.80069 0 0 0 34.89839 242.71103 0 0 0 34.90720 225.25349 0 0 0 34.91600 211.97772 0 0 0 34.92481 206.52516 0 0 0 34.93362 210.21965 0 0 0 34.94243 192.28777 0 0 0 34.95123 177.92548 0 0 0 34.96004 179.15565 0 0 0 34.96885 190.84978 0 0 0 34.97766 206.53033 0 0 0 34.98646 211.71228 0 0 0 34.99527 209.27344 0 0 0 35.00408 207.30823 0 0 0 35.01289 212.39302 0 0 0 35.02169 214.59189 0 0 0 35.03050 217.44821 0 0 0 35.03931 217.11617 0 0 0 35.04812 215.87854 0 0 0 35.05692 209.82948 0 0 0 35.06573 209.28047 0 0 0 35.07453 215.47057 0 0 0 35.08334 209.41518 0 0 0 35.09215 198.18396 0 0 0 35.10096 197.23277 0 0 0 35.10976 215.34409 0 0 0 35.11857 226.14702 0 0 0 35.12738 225.4729 0 0 0 35.13618 218.95601 0 0 0 35.14499 211.80058 0 0 0 35.15380 214.5522 0 0 0 35.16260 219.8237 0 0 0 35.17141 222.95135 0 0 0 35.18022 225.19267 0 0 0 35.18903 222.34897 0 0 0 35.19783 217.62366 0 0 0 35.20664 214.49925 0 0 0 35.21545 216.05882 0 0 0 35.22425 214.9576 0 0 0 loop_ _gsas_i100_meas 7.86 19.05 2.17 9.73 2.75 2.42 12.74 34.00 5.01 100.00 18.66 0.58 3.86 1.20 52.22 9.53 4.86 0.03 12.64 9.51 2.43 1.71 8.67 2.13 1.46 22.23 0.18 4.92 7.38 4.95 0.30 0.07 0.08 1.84 2.64 1.45 0.00 14.68 5.28 0.08 2.54 0.18 0.10 0.44 0.00 0.61 1.15 1.60 10.03 9.97 1.74 0.43 2.46 0.11 1.88 1.40 1.11 0.98 10.46 10.61 0.00 3.71 12.04 0.12 6.71 3.76 2.85 1.01 3.80 0.74 0.03 0.33 2.31 3.43 0.83 2.43 2.65 1.33 0.33 1.56 1.01 2.68 0.00 10.38 1.51 0.00 0.02 1.80 1.11 34.93 1.12 0.11 0.21 0.72 0.97 0.01 3.22 0.01 0.12 1.64 3.32 0.24 1.26 1.30 0.00 2.25 0.11 0.26 2.48 3.22 0.80 2.14 2.30 1.47 2.22 0.01 2.89 1.75 0.17 1.33 0.02 1.27 0.70 0.26 2.58 6.50 0.21 1.75 4.02 0.26 3.21 0.25 0.01 0.00 4.16 0.06 3.29 1.43 0.00 0.44 0.06 0.09 0.47 1.83 0.51 5.68 1.43 2.09 0.58 0.01 0.00 5.40 5.09 0.55 0.55 0.65 0.51 2.49 1.90 0.24 0.16 3.73 0.43 3.17 0.01 0.00 1.75 0.32 4.83 0.00 3.02 0.20 1.08 0.08 0.20 3.51 0.02 0.01 1.02 0.00 1.10 0.03 1.45