#------------------------------------------------------------------------------ #$Date: 2025-07-01 13:39:59 +0300 (Tue, 01 Jul 2025) $ #$Revision: 1111 $ #$URL: svn://localhost/testcod/cif/7/20/00/7200018.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_7200018 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 2020-10-22T09:33 _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 94.711(3) _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 4.7371(3) _cell_length_b 11.82822(30) _cell_length_c 4.16968(24) _cell_measurement_pressure 1.609e7(5) _cell_measurement_temperature 293 _cell_volume 232.84(2) _computing_data_reduction Fit2D _computing_structure_refinement 'GSAS-II (Toby & Von Dreele, J. Appl. Cryst. 46, 544-549, 2013)' _diffrn_ambient_pressure 1.609e7(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 5.6437 _exptl_crystal_description 'white powder' _pd_block_id 2020-10-22T09:33|clau1_016rietveld||id09b _pd_calc_method 'Rietveld Refinement' _pd_meas_number_of_points 4000 _pd_phase_name claudetiteI _pd_prep_pressure 100.0(1) _pd_prep_temperature 293 _pd_proc_info_datetime 2020-10-22T09:33 _pd_proc_ls_background_function ; Background function: "chebyschev" function with 30 terms: 890.9(9), 575(4), 848(10), -1.066(4)e4, -7.289(4)e4, 3.0948(10)e5, 1.70875(5)e6, -5.81267(5)e6, -2.189691(4)e7, 6.810419(10)e7, 1.70279153(17)e8, -5.1116394(4)e8, -8.4971461(5)e8, 2.53689117(6)e9, 2.83569757(5)e9, -8.57689258(10)e9, -6.506691178(28)e9, 2.018352589(8)e10, 1.0406196855(18)e10, -3.3398760689(25)e10, -1.158467337(5)e10, 3.873559204(6)e10, 8.80284481(6)e9, -3.084163377(11)e10, -4.35365505(5)e9, 1.606518972(11)e10, 1.262985214(10)e9, -4.932287156(27)e9, -1.6300944(9)e8, 6.7694865(16)e8, ; _pd_proc_ls_pref_orient_corr ; Simple spherical harmonic correction Order = 6 Coefficients: 0:0:C(2,-2) = -0.115(11); 0:0:C(2,0) = 0.287(11); 0:0:C(2,2) = 0.374(12); 0:0:C(4,-4) = -0.265(16); 0:0:C(4,-2) = -0.202(17); 0:0:C(4,0) = -0.087(13); 0:0:C(4,2) = -0.092(15); 0:0:C(4,4) = 0.381(17); 0:0:C(6,-6) = 0.008(21); 0:0:C(6,-4) = -0.084(16); 0:0:C(6,-2) = -0.092(22); 0:0:C(6,0) = -0.295(20); 0:0:C(6,2) = 0.072(21); 0:0:C(6,4) = -0.043(19); 0:0:C(6,6) = -0.128(17); ; _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 1.15(18)e3, -141(30), 9.0(15), 154.43(29), 31(7), 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 0.00635 _pd_proc_ls_prof_wR_expected 0.03435 _pd_proc_ls_prof_wR_factor 0.00989 _refine_ls_goodness_of_fit_all 0.292 _refine_ls_matrix_type full _refine_ls_number_parameters 72 _refine_ls_R_Fsqd_factor 0.05286 _refine_ls_shift/su_max 0.0002 _refine_ls_wR_factor_obs 0.00989 _reflns_d_resolution_high 0.879 _reflns_d_resolution_low 5.914 _reflns_limit_h_max 5 _reflns_limit_h_min 0 _reflns_limit_k_max 13 _reflns_limit_k_min 0 _reflns_limit_l_max 4 _reflns_limit_l_min -4 _reflns_number_total 361 _cod_data_source_file d0ce01401j3.cif _cod_data_source_block clau1_016rietveld _cod_original_cell_volume 232.844(12) _cod_database_code 7200018 _refine_ls_r_f_factor 0.03038 _gsas_proc_ls_prof_r_b_factor 0.01115 _gsas_proc_ls_prof_wr_b_factor 0.02561 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 0.2818(6) 0.08769(19) 0.0676(7) 1.000 Uiso 0.0044(11) 4 As2 As 0.3223(5) 0.35802(21) 0.0296(7) 1.000 Uiso 0.0044 4 O3 O 0.4591(13) 0.21959(27) 0.0810(32) 1.000 Uiso 0.0044 4 O4 O 0.6612(13) 0.4138(9) 0.1533(11) 1.000 Uiso 0.0044 4 O5 O -0.0668(15) 0.1293(14) 0.1362(13) 1.000 Uiso 0.0044 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 98.8(6) 1_555 1_555 4_454 yes O3 As1 O5 101.3(7) 1_555 1_555 1_555 yes O4 As1 O5 85.98(30) 4_454 1_555 1_555 yes O3 As2 O4 89.7(4) 1_555 1_555 1_555 yes O3 As2 O5 93.3(8) 1_555 1_555 4_554 yes O4 As2 O5 84.7(3) 1_555 1_555 4_554 yes As1 O3 As2 130.1(4) 1_555 1_555 1_555 yes As1 O4 As2 119.4(3) 4_555 1_555 1_555 yes As1 O5 As2 121.7(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 1.7704(28) 1_555 1_555 yes As1 O4 1.7746(28) 1_555 4_454 yes As1 O5 1.7690(28) 1_555 1_555 yes As2 O3 1.7675(28) 1_555 1_555 yes As2 O4 1.7728(28) 1_555 1_555 yes As2 O5 1.7694(28) 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 107.75108 0 0 0 0.01320 108.54211 0 0 0 0.02201 108.17374 0 0 0 0.03081 106.15993 0 0 0 0.03961 104.45514 0 0 0 0.04841 103.31006 0 0 0 0.05721 102.56638 0 0 0 0.06602 101.58092 0 0 0 0.07482 102.01049 0 0 0 0.08362 102.40111 0 0 0 0.09242 104.80543 0 0 0 0.10122 105.22634 0 0 0 0.11003 104.48672 0 0 0 0.11883 104.79964 0 0 0 0.12763 105.69397 0 0 0 0.13643 107.20174 0 0 0 0.14523 109.0219 0 0 0 0.15404 112.08065 0 0 0 0.16284 112.42067 0 0 0 0.17164 109.28347 0 0 0 0.18044 108.68594 0 0 0 0.18925 107.97119 0 0 0 0.19805 106.20763 0 0 0 0.20685 105.7574 0 0 0 0.21565 106.02465 0 0 0 0.22445 107.84001 0 0 0 0.23326 109.74282 0 0 0 0.24206 110.39722 0 0 0 0.25086 110.68694 0 0 0 0.25966 109.38561 0 0 0 0.26846 109.73376 0 0 0 0.27727 109.62036 0 0 0 0.28607 110.99065 0 0 0 0.29487 110.16995 0 0 0 0.30367 110.22374 0 0 0 0.31248 111.13649 0 0 0 0.32128 112.27939 0 0 0 0.33008 113.00645 0 0 0 0.33888 113.08012 0 0 0 0.34768 113.27007 0 0 0 0.35649 112.24192 0 0 0 0.36529 112.31813 0 0 0 0.37409 111.88613 0 0 0 0.38289 111.91282 0 0 0 0.39169 112.0389 0 0 0 0.40050 112.90716 0 0 0 0.40930 113.19648 0 0 0 0.41810 113.01541 0 0 0 0.42690 111.93633 0 0 0 0.43570 111.74146 0 0 0 0.44451 111.98407 0 0 0 0.45331 111.67451 0 0 0 0.46211 111.05241 0 0 0 0.47091 112.2476 0 0 0 0.47972 112.60271 0 0 0 0.48852 111.32698 0 0 0 0.49732 110.32323 0 0 0 0.50612 110.87949 0 0 0 0.51492 110.96875 0 0 0 0.52373 110.92505 0 0 0 0.53253 110.48537 0 0 0 0.54133 109.99883 0 0 0 0.55013 110.18255 0 0 0 0.55893 111.25217 0 0 0 0.56774 111.96506 0 0 0 0.57654 111.63033 0 0 0 0.58534 111.06818 0 0 0 0.59414 110.03263 0 0 0 0.60295 110.3914 0 0 0 0.61175 110.98837 0 0 0 0.62055 111.05203 0 0 0 0.62935 110.42471 0 0 0 0.63815 110.1176 0 0 0 0.64696 109.7342 0 0 0 0.65576 109.9818 0 0 0 0.66456 110.61607 0 0 0 0.67336 110.68476 0 0 0 0.68216 111.1069 0 0 0 0.69097 111.85219 0 0 0 0.69977 112.19557 0 0 0 0.70857 111.98454 0 0 0 0.71737 112.19837 0 0 0 0.72617 112.02582 0 0 0 0.73498 112.19144 0 0 0 0.74378 111.98128 0 0 0 0.75258 112.3677 0 0 0 0.76138 112.4603 0 0 0 0.77019 113.35229 0 0 0 0.77899 113.90072 0 0 0 0.78779 114.33303 0 0 0 0.79659 114.05229 0 0 0 0.80539 113.41315 0 0 0 0.81420 111.97289 0 0 0 0.82300 112.7485 0 0 0 0.83180 113.64659 0 0 0 0.84060 114.41408 0 0 0 0.84940 115.07836 0 0 0 0.85821 114.56661 0 0 0 0.86701 114.88599 0 0 0 0.87581 116.38628 0 0 0 0.88461 118.39961 0 0 0 0.89342 117.97363 0 0 0 0.90222 118.0604 0 0 0 0.91102 118.72357 0 0 0 0.91982 119.28777 0 0 0 0.92862 120.83405 0 0 0 0.93743 123.39874 0 0 0 0.94623 127.28095 0 0 0 0.95503 130.8251 0 0 0 0.96383 133.79494 0 0 0 0.97263 136.15591 0 0 0 0.98144 135.15581 0 0 0 0.99024 136.37677 0 0 0 0.99904 136.48801 0 0 0 1.00784 143.15115 0 0 0 1.01664 150.79364 0 0 0 1.02545 156.56824 0 0 0 1.03425 160.10651 0 0 0 1.04305 167.56047 0 0 0 1.05185 178.20537 0 0 0 1.06066 184.51894 0 0 0 1.06946 190.43477 0 0 0 1.07826 196.04416 0 0 0 1.08706 200.72244 0 0 0 1.09586 204.26631 0 0 0 1.10467 208.71016 0 0 0 1.11347 214.2845 0 0 0 1.12227 220.40044 0 0 0 1.13107 227.81422 0 0 0 1.13987 234.20825 0 0 0 1.14868 236.41164 0 0 0 1.15748 237.01286 0 0 0 1.16628 238.84453 0 0 0 1.17508 242.04543 0 0 0 1.18389 244.89101 0 0 0 1.19269 247.63042 0 0 0 1.20149 249.28145 0 0 0 1.21029 251.21864 0 0 0 1.21909 254.11708 0 0 0 1.22790 257.12125 0 0 0 1.23670 259.06134 0 0 0 1.24550 260.37723 0 0 0 1.25430 260.72488 0 0 0 1.26310 261.76346 0 0 0 1.27191 263.79297 0 0 0 1.28071 265.22284 0 0 0 1.28951 266.09189 0 0 0 1.29831 267.29431 0 0 0 1.30711 269.65152 0 0 0 1.31592 271.85431 0 0 0 1.32472 273.48935 0 0 0 1.33352 274.73767 0 0 0 1.34232 275.83566 0 0 0 1.35113 278.00757 0 0 0 1.35993 280.60458 0 0 0 1.36873 282.23209 0 0 0 1.37753 284.18445 0 0 0 1.38633 284.01102 0 0 0 1.39514 284.72678 0 0 0 1.40394 285.82437 0 0 0 1.41274 288.63483 0 0 0 1.42154 288.84558 0 0 0 1.43034 288.9241 0 0 0 1.43915 289.14847 0 0 0 1.44795 290.00974 0 0 0 1.45675 290.86008 0 0 0 1.46555 291.61685 0 0 0 1.47436 294.14667 0 0 0 1.48316 295.33606 0 0 0 1.49196 296.73358 0 0 0 1.50076 297.20633 0 0 0 1.50956 298.50964 0 0 0 1.51837 299.18195 0 0 0 1.52717 299.62421 0 0 0 1.53597 301.09317 0 0 0 1.54477 302.5307 0 0 0 1.55357 303.1174 0 0 0 1.56238 303.36957 0 0 0 1.57118 304.66043 0 0 0 1.57998 306.47995 0 0 0 1.58878 307.15488 0 0 0 1.59758 307.39355 0 0 0 1.60639 307.54758 0 0 0 1.61519 308.38425 0 0 0 1.62399 310.00916 0 0 0 1.63279 311.18948 0 0 0 1.64160 312.01767 0 0 0 1.65040 312.48541 0 0 0 1.65920 314.10486 0 0 0 1.66800 314.72491 0 0 0 1.67680 314.49384 0 0 0 1.68561 315.14017 0 0 0 1.69441 317.38315 0 0 0 1.70321 319.26685 0 0 0 1.71201 320.12119 0 0 0 1.72081 320.44406 0 0 0 1.72962 320.81149 0 0 0 1.73842 320.65756 0 0 0 1.74722 319.95319 0 0 0 1.75602 319.21628 0 0 0 1.76483 319.53537 0 0 0 1.77363 321.0174 0 0 0 1.78243 323.52194 0 0 0 1.79123 324.86633 0 0 0 1.80003 324.87091 0 0 0 1.80884 325.33386 0 0 0 1.81764 325.28265 0 0 0 1.82644 325.83957 0 0 0 1.83524 327.22641 0 0 0 1.84404 329.5531 0 0 0 1.85285 330.38263 0 0 0 1.86165 330.42532 0 0 0 1.87045 330.08478 0 0 0 1.87925 330.5694 0 0 0 1.88805 331.34857 0 0 0 1.89686 331.54556 0 0 0 1.90566 331.48721 0 0 0 1.91446 332.12192 0 0 0 1.92326 333.59555 0 0 0 1.93207 334.37692 0 0 0 1.94087 334.4595 0 0 0 1.94967 334.733 0 0 0 1.95847 335.5473 0 0 0 1.96727 336.56085 0 0 0 1.97608 336.24667 0 0 0 1.98488 336.59647 0 0 0 1.99368 337.75375 0 0 0 2.00248 338.91943 0 0 0 2.01128 339.21933 0 0 0 2.02009 339.62604 0 0 0 2.02889 339.38181 0 0 0 2.03769 339.65704 0 0 0 2.04649 340.1373 0 0 0 2.05530 341.10193 0 0 0 2.06410 342.23727 0 0 0 2.07290 342.02631 0 0 0 2.08170 342.0488 0 0 0 2.09050 342.62375 0 0 0 2.09931 343.91052 0 0 0 2.10811 345.20914 0 0 0 2.11691 345.88739 0 0 0 2.12571 346.53281 0 0 0 2.13451 347.00528 0 0 0 2.14332 347.48782 0 0 0 2.15212 347.70258 0 0 0 2.16092 348.25543 0 0 0 2.16972 348.53189 0 0 0 2.17852 349.43631 0 0 0 2.18733 349.66037 0 0 0 2.19613 349.64902 0 0 0 2.20493 350.04941 0 0 0 2.21373 349.86575 0 0 0 2.22254 351.64828 0 0 0 2.23134 353.06683 0 0 0 2.24014 353.72531 0 0 0 2.24894 354.03876 0 0 0 2.25774 353.60382 0 0 0 2.26655 353.75613 0 0 0 2.27535 354.5062 0 0 0 2.28415 354.85321 0 0 0 2.29295 355.08548 0 0 0 2.30175 355.24765 0 0 0 2.31056 355.7117 0 0 0 2.31936 356.27786 0 0 0 2.32816 356.97183 0 0 0 2.33696 357.20215 0 0 0 2.34576 357.65717 0 0 0 2.35457 358.27173 0 0 0 2.36337 359.47424 0 0 0 2.37217 359.45819 0 0 0 2.38097 359.89209 0 0 0 2.38978 360.44885 0 0 0 2.39858 361.89728 0 0 0 2.40738 362.63779 0 0 0 2.41618 362.58182 0 0 0 2.42498 362.65509 0 0 0 2.43379 362.80661 0 0 0 2.44259 363.50293 0 0 0 2.45139 363.84244 0 0 0 2.46019 364.17184 0 0 0 2.46899 363.5386 0 0 0 2.47780 363.60876 0 0 0 2.48660 364.75925 0 0 0 2.49540 365.71777 0 0 0 2.50420 366.00034 0 0 0 2.51301 365.73975 0 0 0 2.52181 366.27094 0 0 0 2.53061 366.97913 0 0 0 2.53941 368.32358 0 0 0 2.54821 369.09647 0 0 0 2.55702 369.52042 0 0 0 2.56582 368.74191 0 0 0 2.57462 369.04709 0 0 0 2.58342 369.88699 0 0 0 2.59222 370.4256 0 0 0 2.60103 370.58908 0 0 0 2.60983 370.25504 0 0 0 2.61863 371.03433 0 0 0 2.62743 372.06604 0 0 0 2.63624 371.70889 0 0 0 2.64504 370.99557 0 0 0 2.65384 371.32565 0 0 0 2.66264 372.172 0 0 0 2.67144 372.64771 0 0 0 2.68025 373.41455 0 0 0 2.68905 374.10995 0 0 0 2.69785 374.71622 0 0 0 2.70665 374.15228 0 0 0 2.71545 373.83313 0 0 0 2.72426 375.04596 0 0 0 2.73306 376.33997 0 0 0 2.74186 376.90521 0 0 0 2.75066 376.33279 0 0 0 2.75946 376.26819 0 0 0 2.76827 376.70526 0 0 0 2.77707 377.10654 0 0 0 2.78587 377.39767 0 0 0 2.79467 377.38541 0 0 0 2.80348 377.74918 0 0 0 2.81228 378.10663 0 0 0 2.82108 378.81754 0 0 0 2.82988 379.63699 0 0 0 2.83868 380.73636 0 0 0 2.84749 380.68835 0 0 0 2.85629 380.97089 0 0 0 2.86509 380.96518 0 0 0 2.87389 381.48328 0 0 0 2.88269 381.4545 0 0 0 2.89150 381.7482 0 0 0 2.90030 381.13791 0 0 0 2.90910 381.33286 0 0 0 2.91790 382.00085 388.718734 388.695605 0.002617795 2.92670 382.08627 388.413256 388.389903 0.00261721 2.93551 381.77954 388.071087 388.047506 0.002619313 2.94431 381.3688 387.705132 387.68132 0.002622134 2.95311 381.62842 387.337952 387.302603 0.00262035 2.96191 382.71906 386.956883 386.921251 0.002612883 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186.13528 0 0 0 33.55808 194.99588 0 0 0 33.56688 203.79951 0 0 0 33.57569 199.86234 0 0 0 33.58449 196.81784 0 0 0 33.59329 191.03539 0 0 0 33.60209 185.03831 0 0 0 33.61089 183.46579 0 0 0 33.61970 181.35139 0 0 0 33.62850 181.82794 0 0 0 33.63730 188.08084 0 0 0 33.64610 199.21516 0 0 0 33.65491 205.76595 0 0 0 33.66371 196.10815 0 0 0 33.67251 196.61372 0 0 0 33.68131 204.63354 0 0 0 33.69011 201.35201 0 0 0 33.69892 192.75569 0 0 0 33.70772 189.9106 0 0 0 33.71652 199.69487 0 0 0 33.72532 212.81915 0 0 0 33.73412 213.6828 0 0 0 33.74293 204.78589 0 0 0 33.75173 199.3573 0 0 0 33.76053 200.56868 0 0 0 33.76933 207.13908 0 0 0 33.77813 207.49046 0 0 0 33.78694 204.29088 0 0 0 33.79574 201.81505 0 0 0 33.80454 198.21289 0 0 0 33.81334 193.88713 0 0 0 33.82215 184.69214 0 0 0 33.83095 186.53027 0 0 0 33.83975 192.90678 0 0 0 33.84855 192.36757 0 0 0 33.85735 186.0352 0 0 0 33.86616 194.95236 0 0 0 33.87496 209.86479 0 0 0 33.88376 204.69437 0 0 0 33.89256 208.20836 0 0 0 33.90136 202.29756 0 0 0 33.91017 197.48428 0 0 0 33.91897 196.10645 0 0 0 33.92777 194.5293 0 0 0 33.93657 206.09409 0 0 0 33.94537 207.69556 0 0 0 33.95418 199.36194 0 0 0 33.96298 197.3535 0 0 0 33.97178 199.78456 0 0 0 33.98058 195.39592 0 0 0 33.98939 197.19846 0 0 0 33.99819 198.91463 0 0 0 34.00699 196.41241 0 0 0 34.01579 192.3102 0 0 0 34.02459 198.12669 0 0 0 34.03340 207.42665 0 0 0 34.04220 196.87035 0 0 0 34.05100 185.76334 0 0 0 34.05980 182.90529 0 0 0 34.06860 193.8367 0 0 0 34.07741 205.77719 0 0 0 34.08621 203.85475 0 0 0 34.09501 201.61192 0 0 0 34.10381 202.26938 0 0 0 34.11262 207.2318 0 0 0 34.12142 218.88737 0 0 0 34.13022 223.51598 0 0 0 34.13902 214.54553 0 0 0 34.14782 206.38617 0 0 0 34.15663 204.6178 0 0 0 34.16543 205.9212 0 0 0 34.17423 208.12418 0 0 0 34.18303 204.24565 0 0 0 34.19183 205.90071 0 0 0 34.20064 204.38792 0 0 0 34.20944 210.59166 0 0 0 34.21824 221.25302 0 0 0 34.22704 216.94901 0 0 0 34.23584 204.91605 0 0 0 34.24465 207.26204 0 0 0 34.25345 214.40648 0 0 0 34.26225 211.19553 0 0 0 34.27105 204.96416 0 0 0 34.27986 205.5929 0 0 0 34.28866 211.75636 0 0 0 34.29746 209.2917 0 0 0 34.30626 206.47371 0 0 0 34.31506 200.92758 0 0 0 34.32387 199.64363 0 0 0 34.33267 207.08681 0 0 0 34.34147 210.0009 0 0 0 34.35027 209.69128 0 0 0 34.35907 207.17621 0 0 0 34.36788 206.87964 0 0 0 34.37668 218.17456 0 0 0 34.38548 221.64873 0 0 0 34.39428 210.13489 0 0 0 34.40308 198.85298 0 0 0 34.41189 199.69647 0 0 0 34.42069 205.61131 0 0 0 34.42949 212.00325 0 0 0 34.43829 214.82361 0 0 0 34.44710 215.54977 0 0 0 34.45590 217.17758 0 0 0 34.46470 222.90172 0 0 0 34.47350 214.71828 0 0 0 34.48230 213.84819 0 0 0 34.49111 206.83701 0 0 0 34.49991 203.44681 0 0 0 34.50871 199.60497 0 0 0 34.51751 200.70581 0 0 0 34.52631 209.6851 0 0 0 34.53512 217.04976 0 0 0 34.54392 216.45424 0 0 0 34.55272 215.87361 0 0 0 34.56152 210.92018 0 0 0 34.57033 209.87843 0 0 0 34.57913 210.54736 0 0 0 34.58793 210.42343 0 0 0 34.59673 211.03691 0 0 0 34.60553 207.44206 0 0 0 34.61434 211.00238 0 0 0 34.62314 211.97153 0 0 0 34.63194 208.69109 0 0 0 34.64074 203.07628 0 0 0 34.64954 198.78764 0 0 0 34.65835 204.8605 0 0 0 34.66715 198.42647 0 0 0 34.67595 182.17238 0 0 0 34.68475 189.20491 0 0 0 34.69355 211.28203 0 0 0 34.70236 210.61285 0 0 0 34.71116 218.42441 0 0 0 34.71996 229.61621 0 0 0 34.72876 232.03142 0 0 0 34.73757 225.33826 0 0 0 34.74637 215.16261 0 0 0 34.75517 205.58646 0 0 0 34.76397 204.17905 0 0 0 34.77277 205.4427 0 0 0 34.78158 199.89061 0 0 0 34.79038 195.61752 0 0 0 34.79918 201.28246 0 0 0 34.80798 206.77365 0 0 0 34.81678 221.29056 0 0 0 34.82559 220.27022 0 0 0 34.83439 217.08032 0 0 0 34.84319 218.70927 0 0 0 34.85199 205.84416 0 0 0 34.86079 194.49858 0 0 0 34.86960 189.61203 0 0 0 34.87840 196.91644 0 0 0 34.88720 204.36345 0 0 0 34.89600 216.07739 0 0 0 34.90481 218.66991 0 0 0 34.91361 199.54947 0 0 0 34.92241 183.68254 0 0 0 34.93121 192.41209 0 0 0 34.94001 207.1579 0 0 0 34.94882 210.84804 0 0 0 34.95762 212.3614 0 0 0 34.96642 210.30888 0 0 0 34.97522 207.73135 0 0 0 34.98402 201.29607 0 0 0 34.99283 200.89772 0 0 0 35.00163 207.31764 0 0 0 35.01043 210.15039 0 0 0 35.01923 208.45786 0 0 0 35.02804 204.57013 0 0 0 35.03684 211.97935 0 0 0 35.04564 213.45573 0 0 0 35.05444 214.83545 0 0 0 35.06324 213.24655 0 0 0 35.07205 204.72818 0 0 0 35.08085 211.68785 0 0 0 35.08965 218.00075 0 0 0 35.09845 221.49983 0 0 0 35.10725 224.94632 0 0 0 35.11606 218.74596 0 0 0 35.12486 216.08507 0 0 0 35.13366 215.97505 0 0 0 35.14246 217.58624 0 0 0 35.15126 224.84174 0 0 0 35.16007 228.62462 0 0 0 35.16887 221.51027 0 0 0 35.17767 217.90714 0 0 0 35.18647 210.38347 0 0 0 35.19528 204.72855 0 0 0 35.20408 208.38385 0 0 0 loop_ _gsas_i100_meas 1.88 14.58 3.08 2.38 6.13 0.95 44.52 16.43 65.88 91.28 84.08 23.49 1.38 0.57 43.32 100.00 1.37 64.40 24.95 24.39 6.27 0.10 2.96 11.36 3.83 47.24 5.90 38.34 7.27 1.16 4.67 0.01 0.03 3.68 2.79 0.52 7.05 2.29 12.67 26.42 21.67 6.39 10.83 0.02 3.14 0.06 0.00 0.54 17.40 0.29 6.42 9.44 1.44 13.95 6.28 5.74 0.75 11.79 11.21 0.09 10.17 35.90 0.03 0.61 3.40 2.16 5.10 4.79 3.24 0.42 5.91 1.61 3.85 20.44 1.00 3.00 0.01 3.87 4.15 0.76 2.09 7.44 0.06 9.89 0.21 17.14 33.23 23.83 3.81 1.87 0.47 5.44 3.96 0.47 0.67 2.00 7.56 1.72 0.46 5.78 0.89 0.15 2.12 2.60 0.14 0.74 19.23 4.18 0.47 5.46 20.86 1.90 2.53 12.71 6.55 3.64 1.28 0.11 0.12 0.34 2.09 0.28 0.21 4.71 2.16 0.00 23.43 2.58 0.86 3.85 0.05 0.26 0.02 0.10 3.21 2.71 1.00 0.28 0.47 0.49 3.00 0.05 0.27 12.04 13.27 0.50 0.78 0.01 10.37 0.30 1.17 2.41 0.15 0.30 0.22 2.92 2.49 4.90 6.59 0.12 2.11 7.41 0.72 0.79 2.00 2.11 0.06 0.40 1.01 3.12 2.55 2.43 2.23 0.49 0.06 0.01 0.29 0.78 0.11 0.76 0.02 0.53 0.02 0.00 0.85 0.43 0.01 0.02 0.07 0.73 0.00 2.09 0.76 2.86 2.97 8.02 5.88 0.98 0.54 0.42 0.82 1.12 0.50 0.78 0.09 1.20 0.01 0.53 0.90 0.39 1.44 2.11 7.02 2.68 0.17 0.00 4.32 0.07 1.72 0.11 0.02 0.77 0.57 0.37 0.76 0.14 2.59 1.06 0.00 1.46 4.05 2.73 1.70 0.77 6.38 0.18 0.23 4.02 0.69 0.26 1.28 5.87 3.83 0.10 0.81 1.66 1.83 0.38 1.03 0.06 0.09 2.17 0.17 0.23 0.42 2.34 6.58 1.23 0.53 2.55 0.21 0.00 0.12 0.40 0.19 1.70 1.24 0.29 0.57 0.03 0.23 1.40 3.37 2.60 7.62 0.10 0.10 1.49 0.12 0.08 0.00 0.86 0.11 1.65 0.31 6.66 0.64 1.24 4.97 0.06 0.26 0.09 1.15 0.11 0.37 1.81 1.18 0.34 0.06 0.08 0.19 1.21 0.91 1.10 6.67 0.00 0.04 0.01 0.00 1.70 0.53 0.65 0.26 0.35 4.19 1.49 0.96 0.44 0.27 0.78 1.68 0.26 0.20 0.18 0.50 0.08 5.16 1.72 0.10 1.49 0.25 0.31 0.01 1.01 0.00 0.71 6.23 0.00 0.52 0.07 2.08 0.00 0.00 0.54 0.10 0.13 0.15 0.11 0.27 0.00 4.43 4.05 0.27 0.11 0.68 2.77 0.10 0.27 1.51 2.12 0.18