#------------------------------------------------------------------------------
#$Date: 2018-06-12 18:46:26 +0300 (Tue, 12 Jun 2018) $
#$Revision: 208302 $
#$URL: file:///home/coder/svn-repositories/cod/cif/2/24/25/2242532.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2242532
loop_
_publ_author_name
'Massoni, Nicolas'
'Hegron, Ronan'
'Campayo, Lionel'
_publ_section_title
;
 Reinvestigation of the crystal structure of Ca₂Ce₈(SiO₄)₆O₂
 apatite by Rietveld refinement
;
_journal_issue                   7
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              955
_journal_page_last               959
_journal_paper_doi               10.1107/S2056989018008435
_journal_volume                  74
_journal_year                    2018
_chemical_formula_iupac          'Ca2 Ce8 (Si O4)6 O2'
_chemical_formula_structural     'Ca2 Ce8 O26 Si6'
_chemical_formula_sum            'Ca2 Ce8 O26 Si6'
_chemical_formula_weight         1785.6
_chemical_name_systematic
;
Dicalcium octacerium hexakis(silicate) dioxide
;
_space_group_crystal_system      hexagonal
_space_group_IT_number           176
_space_group_name_Hall           '-P 6c'
_space_group_name_H-M_alt        'P 63/m'
_symmetry_space_group_name_Hall  '-P 6c'
_symmetry_space_group_name_H-M   'P 63/m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   9.59912(6)
_cell_length_b                   9.59912(6)
_cell_length_c                   7.09284(6)
_cell_measurement_reflns_used    353
_cell_measurement_temperature    293
_cell_measurement_theta_max      65.005
_cell_measurement_theta_min      5.0115
_cell_volume                     565.996(7)
_computing_cell_refinement
;
JANA2006 (Petříček et al.,  2014)
;
_computing_data_collection
;
Data Collector (Panalytical, 2011)
;
_computing_data_reduction
;
JANA2006 (Petříček et al.,  2014)
;
_computing_molecular_graphics
;
VESTA (Momma & Izumi, 2011)
;
_computing_publication_material
;
publCIF (Westrip, 2010)
;
_computing_structure_refinement
;
JANA2006 (Petříček et al.,  2014)
;
_computing_structure_solution
;
JANA2006 (Petříček et al.,  2014)
;
_diffrn_ambient_temperature      293
_diffrn_measurement_device_type  'Panalytical XPert MPD Pro'
_diffrn_radiation_type           'Cu K\a~1~'
_diffrn_radiation_wavelength     1.54176
_exptl_crystal_density_diffrn    5.2387
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             796
_pd_block_diffractogram_id       cacesioprofile
_pd_char_colour                  brown
_pd_char_particle_morphology     plate-like
_pd_meas_2theta_range_inc        0.017
_pd_meas_2theta_range_max        130.010
_pd_meas_2theta_range_min        10.023
_pd_meas_number_of_points        6881
_pd_meas_scan_method             step
_pd_prep_cool_rate               30
_pd_prep_pressure                100
_pd_prep_temperature             1873
_pd_proc_ls_background_function  'Legendre polynoms'
_pd_proc_ls_profile_function     pseudo-Voigt
_pd_proc_ls_prof_R_factor        0.0453
_pd_proc_ls_prof_wR_expected     0.0336
_pd_proc_ls_prof_wR_factor       0.0593
_pd_spec_mounting                ' packed powder pellet'
_pd_spec_mount_mode              reflection
_pd_spec_shape                   flat_sheet
_pd_spec_size_axial              25
_pd_spec_size_equat              25
_pd_spec_size_thick              1
_refine_diff_density_max         3.87
_refine_diff_density_min         -1.88
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_all   1.76
_refine_ls_goodness_of_fit_ref   1.76
_refine_ls_number_constraints    9
_refine_ls_number_parameters     28
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0458
_refine_ls_R_factor_gt           0.0438
_refine_ls_shift/su_max          0.0054
_refine_ls_shift/su_mean         0.0014
_refine_ls_weighting_scheme      sigma
_refine_ls_wR_factor_all         0.0442
_refine_ls_wR_factor_gt          0.0438
_cod_data_source_file            wm5448sup1.cif
_cod_data_source_block           I
_cod_database_code               2242532
loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 x,y,z
2 -y,x-y,z
3 -x+y,-x,z
4 -x,-y,z+1/2
5 y,-x+y,z+1/2
6 x-y,x,z+1/2
7 -x,-y,-z
8 y,-x+y,-z
9 x-y,x,-z
10 x,y,-z+1/2
11 -y,x-y,-z+1/2
12 -x+y,-x,-z+1/2
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_calc_flag
_atom_site_occupancy
Ca Ca_a 0.333333 0.666667 -0.0009(7) 0.008 Uiso d 0.5
Ce Ce_a 0.333333 0.666667 -0.0009(7) 0.008 Uiso d 0.5
Ce Ce_b 0.23194(13) -0.01214(18) 0.25 0.006 Uiso d 1
Si Si_c 0.4040(6) 0.3713(6) 0.25 0.005 Uiso d 1
O O1_c 0.3293(13) 0.4865(12) 0.25 0.003 Uiso d 1
O O2_c 0.5980(14) 0.4634(13) 0.25 0.003 Uiso d 1
O O3_c 0.3410(7) 0.2594(8) 0.0668(9) 0.003 Uiso d 1
O O4_d 0 0 0.25 0.003 Uiso d 1
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Ca Ca 0.3641 1.2855 'International Tables for Crystallography (Vol. IV)'
Ce Ce -1.8482 9.6596 'International Tables for Crystallography (Vol. IV)'
Si Si 0.2541 0.3302 'International Tables for Crystallography (Vol. IV)'
O O 0.0492 0.0322 'International Tables for Crystallography (Vol. IV)'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle
Ca_a Ca_a Ca_a 10_554 10_555 180.0(5)
Ca_a Ca_a Ce_a 10_554 . 0
Ca_a Ca_a Ce_a 10_554 10_554 0.0(5)
Ca_a Ca_a Ce_a 10_554 10_555 180.0(5)
Ca_a Ca_a Si_c 10_554 4_664 57.01(10)
Ca_a Ca_a Si_c 10_554 5_564 57.01(11)
Ca_a Ca_a Si_c 10_554 6_554 57.01(9)
Ca_a Ca_a O2_c 10_554 4_664 43.5(3)
Ca_a Ca_a O2_c 10_554 5_564 43.5(3)
Ca_a Ca_a O2_c 10_554 6_554 43.5(3)
Ca_a Ca_a Ce_a 10_555 . 0
Ca_a Ca_a Ce_a 10_555 10_554 180.0(5)
Ca_a Ca_a Ce_a 10_555 10_555 0.0(5)
Ca_a Ca_a Si_c 10_555 4_664 122.99(10)
Ca_a Ca_a Si_c 10_555 5_564 122.99(11)
Ca_a Ca_a Si_c 10_555 6_554 122.99(9)
Ca_a Ca_a O2_c 10_555 4_664 136.5(3)
Ca_a Ca_a O2_c 10_555 5_564 136.5(3)
Ca_a Ca_a O2_c 10_555 6_554 136.5(3)
Ce_a Ca_a Ce_a . 10_554 0
Ce_a Ca_a Ce_a . 10_555 0
Ce_a Ca_a Si_c . 4_664 0
Ce_a Ca_a Si_c . 5_564 0
Ce_a Ca_a Si_c . 6_554 0
Ce_a Ca_a O2_c . 4_664 0
Ce_a Ca_a O2_c . 5_564 0
Ce_a Ca_a O2_c . 6_554 0
Ce_a Ca_a Ce_a 10_554 10_555 180.0(5)
Ce_a Ca_a Si_c 10_554 4_664 57.01(10)
Ce_a Ca_a Si_c 10_554 5_564 57.01(11)
Ce_a Ca_a Si_c 10_554 6_554 57.01(9)
Ce_a Ca_a O2_c 10_554 4_664 43.5(3)
Ce_a Ca_a O2_c 10_554 5_564 43.5(3)
Ce_a Ca_a O2_c 10_554 6_554 43.5(3)
Ce_a Ca_a Si_c 10_555 4_664 122.99(10)
Ce_a Ca_a Si_c 10_555 5_564 122.99(11)
Ce_a Ca_a Si_c 10_555 6_554 122.99(9)
Ce_a Ca_a O2_c 10_555 4_664 136.5(3)
Ce_a Ca_a O2_c 10_555 5_564 136.5(3)
Ce_a Ca_a O2_c 10_555 6_554 136.5(3)
Si_c Ca_a Si_c 4_664 5_564 93.17(18)
Si_c Ca_a Si_c 4_664 6_554 93.17(18)
Si_c Ca_a O2_c 4_664 4_664 28.7(3)
Si_c Ca_a O2_c 4_664 5_564 64.6(4)
Si_c Ca_a O2_c 4_664 6_554 97.0(4)
Si_c Ca_a Si_c 5_564 6_554 93.17(16)
Si_c Ca_a O2_c 5_564 4_664 97.0(3)
Si_c Ca_a O2_c 5_564 5_564 28.7(4)
Si_c Ca_a O2_c 5_564 6_554 64.6(3)
Si_c Ca_a O2_c 6_554 4_664 64.6(3)
Si_c Ca_a O2_c 6_554 5_564 97.0(2)
Si_c Ca_a O2_c 6_554 6_554 28.7(3)
O2_c Ca_a O2_c 4_664 5_564 73.2(5)
O2_c Ca_a O2_c 4_664 6_554 73.2(5)
O2_c Ca_a O2_c 5_564 6_554 73.2(3)
Ca_a Ce_a Ca_a . 10_554 0
Ca_a Ce_a Ca_a . 10_555 0
Ca_a Ce_a Ce_a . 10_554 0
Ca_a Ce_a Ce_a . 10_555 0
Ca_a Ce_a O1_c . . 0
Ca_a Ce_a O1_c . 2_665 0
Ca_a Ce_a O1_c . 3_565 0
Ca_a Ce_a O2_c . 4_664 0
Ca_a Ce_a O2_c . 5_564 0
Ca_a Ce_a O2_c . 6_554 0
Ca_a Ce_a Ca_a 10_554 10_555 180.0(5)
Ca_a Ce_a Ce_a 10_554 10_554 0.0(5)
Ca_a Ce_a Ce_a 10_554 10_555 180.0(5)
Ca_a Ce_a O1_c 10_554 . 136.1(2)
Ca_a Ce_a O1_c 10_554 2_665 136.13(19)
Ca_a Ce_a O1_c 10_554 3_565 136.1(3)
Ca_a Ce_a O2_c 10_554 4_664 43.5(3)
Ca_a Ce_a O2_c 10_554 5_564 43.5(3)
Ca_a Ce_a O2_c 10_554 6_554 43.5(3)
Ca_a Ce_a Ce_a 10_555 10_554 180.0(5)
Ca_a Ce_a Ce_a 10_555 10_555 0.0(5)
Ca_a Ce_a O1_c 10_555 . 43.9(2)
Ca_a Ce_a O1_c 10_555 2_665 43.87(19)
Ca_a Ce_a O1_c 10_555 3_565 43.9(3)
Ca_a Ce_a O2_c 10_555 4_664 136.5(3)
Ca_a Ce_a O2_c 10_555 5_564 136.5(3)
Ca_a Ce_a O2_c 10_555 6_554 136.5(3)
Ce_a Ce_a Ce_a 10_554 10_555 180.0(5)
Ce_a Ce_a O1_c 10_554 . 136.1(2)
Ce_a Ce_a O1_c 10_554 2_665 136.13(19)
Ce_a Ce_a O1_c 10_554 3_565 136.1(3)
Ce_a Ce_a O2_c 10_554 4_664 43.5(3)
Ce_a Ce_a O2_c 10_554 5_564 43.5(3)
Ce_a Ce_a O2_c 10_554 6_554 43.5(3)
Ce_a Ce_a O1_c 10_555 . 43.9(2)
Ce_a Ce_a O1_c 10_555 2_665 43.87(19)
Ce_a Ce_a O1_c 10_555 3_565 43.9(3)
Ce_a Ce_a O2_c 10_555 4_664 136.5(3)
Ce_a Ce_a O2_c 10_555 5_564 136.5(3)
Ce_a Ce_a O2_c 10_555 6_554 136.5(3)
O1_c Ce_a O1_c . 2_665 73.8(4)
O1_c Ce_a O1_c . 3_565 73.8(4)
O1_c Ce_a O2_c . 4_664 94.4(3)
O1_c Ce_a O2_c . 5_564 153.3(4)
O1_c Ce_a O2_c . 6_554 126.7(3)
O1_c Ce_a O1_c 2_665 3_565 73.8(4)
O1_c Ce_a O2_c 2_665 4_664 126.7(4)
O1_c Ce_a O2_c 2_665 5_564 94.4(3)
O1_c Ce_a O2_c 2_665 6_554 153.3(6)
O1_c Ce_a O2_c 3_565 4_664 153.3(3)
O1_c Ce_a O2_c 3_565 5_564 126.7(5)
O1_c Ce_a O2_c 3_565 6_554 94.4(4)
O2_c Ce_a O2_c 4_664 5_564 73.2(5)
O2_c Ce_a O2_c 4_664 6_554 73.2(5)
O2_c Ce_a O2_c 5_564 6_554 73.2(3)
O3_c Ce_b O3_c 5_555 8_555 139.4(4)
O3_c Ce_b O4_d 5_555 . 105.0(2)
O3_c Ce_b O4_d 8_555 . 105.0(2)
Ca_a Si_c Ca_a 4_665 7_665 65.98(17)
Ca_a Si_c O1_c 4_665 . 136.4(2)
Ca_a Si_c O2_c 4_665 . 46.6(4)
Ca_a Si_c O3_c 4_665 . 114.9(5)
Ca_a Si_c O3_c 4_665 10_555 62.4(3)
Ca_a Si_c O1_c 7_665 . 136.4(2)
Ca_a Si_c O2_c 7_665 . 46.6(4)
Ca_a Si_c O3_c 7_665 . 62.4(3)
Ca_a Si_c O3_c 7_665 10_555 114.9(5)
O1_c Si_c O2_c . . 114.7(7)
O1_c Si_c O3_c . . 108.5(5)
O1_c Si_c O3_c . 10_555 108.5(5)
O2_c Si_c O3_c . . 108.2(5)
O2_c Si_c O3_c . 10_555 108.2(5)
O3_c Si_c O3_c . 10_555 108.6(4)
Ce_a O1_c Ce_a . 10_555 92.3(5)
Ce_a O1_c Si_c . . 129.2(3)
Ce_a O1_c Si_c 10_555 . 129.2(3)
Ca_a O2_c Ca_a 4_665 7_665 93.0(5)
Ca_a O2_c Ce_a 4_665 4_665 0.0(5)
Ca_a O2_c Ce_a 4_665 7_665 93.0(5)
Ca_a O2_c Si_c 4_665 . 104.7(4)
Ca_a O2_c Ce_a 7_665 4_665 93.0(5)
Ca_a O2_c Ce_a 7_665 7_665 0.0(5)
Ca_a O2_c Si_c 7_665 . 104.7(4)
Ce_a O2_c Ce_a 4_665 7_665 93.0(5)
Ce_a O2_c Si_c 4_665 . 104.7(4)
Ce_a O2_c Si_c 7_665 . 104.7(4)
Ce_b O3_c Si_c 6_554 . 146.2(5)
Ce_b O4_d Ce_b . 2_555 120.00(5)
Ce_b O4_d Ce_b . 3_555 120.00(6)
Ce_b O4_d Ce_b 2_555 3_555 120.00(6)
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_2
_geom_bond_distance
Ca_a Ca_a 10_554 3.534(7)
Ca_a Ca_a 10_555 3.559(7)
Ca_a Ce_a . 0
Ca_a Ce_a 10_554 3.534(7)
Ca_a Ce_a 10_555 3.559(7)
Ca_a Si_c 4_664 3.246(6)
Ca_a Si_c 5_564 3.246(8)
Ca_a Si_c 6_554 3.246(5)
Ca_a O2_c 4_664 2.437(11)
Ca_a O2_c 5_564 2.437(10)
Ca_a O2_c 6_554 2.437(13)
Ce_a Ce_a 10_554 3.534(7)
Ce_a Ce_a 10_555 3.559(7)
Ce_a O1_c . 2.468(10)
Ce_a O1_c 2_665 2.468(8)
Ce_a O1_c 3_565 2.468(13)
Ce_a O2_c 4_664 2.437(11)
Ce_a O2_c 5_564 2.437(10)
Ce_a O2_c 6_554 2.437(13)
Ce_b O3_c 5_555 2.396(7)
Ce_b O3_c 8_555 2.396(7)
Ce_b O4_d . 2.2870(15)
Si_c O1_c . 1.590(16)
Si_c O2_c . 1.614(13)
Si_c O3_c . 1.600(7)
Si_c O3_c 10_555 1.600(7)
loop_
_pd_proc_2theta_corrected
_pd_proc_ls_weight
_pd_proc_intensity_net
_pd_calc_intensity_net
10.0509 53.00 2850.00 2799.48
10.0684 53.00 2811.00 2796.32
10.0858 52.00 2753.00 2793.18
10.1032 52.00 2705.00 2790.08
10.1207 53.00 2806.00 2787.01
10.1381 53.00 2853.00 2783.98
10.1556 53.00 2804.00 2781.00
10.1730 52.00 2750.00 2778.07
10.1904 52.00 2745.00 2775.20
10.2079 53.00 2860.00 2772.40
10.2253 53.00 2762.00 2769.68
10.2428 53.00 2827.00 2767.07
10.2602 53.00 2837.00 2764.57
10.2776 53.00 2836.00 2762.23
10.2951 54.00 2879.00 2760.08
10.3125 53.00 2850.00 2758.19
10.3300 53.00 2758.00 2756.60
10.3474 53.00 2815.00 2755.33
10.3648 53.00 2848.00 2754.48
10.3823 53.00 2862.00 2754.25
10.3997 54.00 2884.00 2754.90
10.4171 53.00 2800.00 2756.84
10.4346 53.00 2782.00 2760.69
10.4520 54.00 2921.00 2767.37
10.4695 54.00 2894.00 2778.28
10.4869 53.00 2788.00 2795.57
10.5043 54.00 2881.00 2822.72
10.5218 54.00 2921.00 2865.72
10.5392 55.00 3021.00 2935.20
10.5567 55.00 3000.00 3048.66
10.5741 55.00 3067.00 3227.41
10.5915 57.00 3286.00 3479.09
10.6090 57.00 3301.00 3762.02
10.6264 58.00 3416.00 3956.78
10.6439 59.00 3526.00 3928.19
10.6613 59.00 3482.00 3686.09
10.6788 58.00 3356.00 3364.18
10.6962 54.00 2933.00 3090.97
10.7136 54.00 2881.00 2913.51
10.7311 53.00 2822.00 2814.67
10.7485 52.00 2723.00 2762.11
10.7659 53.00 2829.00 2732.19
10.7834 52.00 2737.00 2712.71
10.8008 52.00 2691.00 2698.43
10.8183 51.00 2645.00 2687.17
10.8357 51.00 2644.00 2677.88
10.8531 52.00 2756.00 2669.97
10.8706 52.00 2751.00 2663.05
10.8880 51.00 2592.00 2656.86
10.9055 51.00 2595.00 2651.22
10.9229 52.00 2718.00 2645.98
10.9403 51.00 2610.00 2641.04
10.9578 51.00 2627.00 2636.38
10.9752 51.00 2635.00 2631.98
10.9927 52.00 2659.00 2627.77
11.0101 51.00 2647.00 2623.73
11.0275 51.00 2559.00 2619.80
11.0450 51.00 2593.00 2615.98
11.0624 51.00 2605.00 2612.25
11.0799 51.00 2571.00 2608.58
11.0973 51.00 2636.00 2604.98
11.1147 51.00 2605.00 2601.44
11.1322 51.00 2606.00 2597.94
11.1496 50.00 2522.00 2594.49
11.1671 51.00 2610.00 2591.07
11.1845 50.00 2508.00 2587.69
11.2019 51.00 2638.00 2584.33
11.2194 52.00 2708.00 2580.98
11.2368 51.00 2639.00 2577.54
11.2542 51.00 2558.00 2572.18
11.2717 51.00 2630.00 2568.02
11.2891 50.00 2529.00 2564.95
11.3066 50.00 2519.00 2561.88
11.3240 51.00 2624.00 2558.81
11.3414 51.00 2603.00 2555.75
11.3589 51.00 2597.00 2552.69
11.3763 51.00 2601.00 2549.64
11.3938 51.00 2578.00 2546.59
11.4112 50.00 2506.00 2543.55
11.4286 50.00 2509.00 2540.51
11.4461 51.00 2589.00 2537.48
11.4635 50.00 2498.00 2534.45
11.4810 51.00 2626.00 2531.43
11.4984 50.00 2488.00 2528.41
11.5159 52.00 2664.00 2525.39
11.5333 51.00 2638.00 2522.38
11.5507 52.00 2668.00 2519.38
11.5682 50.00 2526.00 2516.38
11.5856 50.00 2487.00 2513.38
11.6030 50.00 2468.00 2510.39
11.6205 49.00 2450.00 2507.40
11.6379 50.00 2474.00 2504.42
11.6554 50.00 2536.00 2501.44
11.6728 50.00 2518.00 2498.47
11.6902 50.00 2525.00 2495.50
11.7077 50.00 2461.00 2492.54
11.7251 50.00 2534.00 2489.58
11.7426 50.00 2504.00 2486.63
11.7600 50.00 2525.00 2483.68
11.7774 49.00 2402.00 2480.73
11.7949 50.00 2463.00 2477.79
11.8123 50.00 2463.00 2474.86
11.8298 50.00 2506.00 2471.93
11.8472 49.00 2384.00 2469.00
11.8646 50.00 2488.00 2466.08
11.8821 49.00 2417.00 2463.16
11.8995 49.00 2437.00 2460.25
11.9170 50.00 2501.00 2457.34
11.9344 50.00 2496.00 2454.43
11.9518 50.00 2533.00 2451.53
11.9693 49.00 2406.00 2448.64
11.9867 49.00 2435.00 2445.75
12.0042 49.00 2405.00 2442.86
12.0216 49.00 2402.00 2439.98
12.0390 49.00 2444.00 2437.10
12.0565 49.00 2405.00 2434.23
12.0739 50.00 2518.00 2431.36
12.0913 49.00 2448.00 2428.50
12.1088 49.00 2407.00 2425.64
12.1262 50.00 2524.00 2422.78
12.1437 49.00 2430.00 2419.93
12.1611 50.00 2487.00 2417.09
12.1785 50.00 2453.00 2414.25
12.1960 49.00 2416.00 2411.41
12.2134 50.00 2451.00 2408.58
12.2309 50.00 2550.00 2405.75
12.2483 49.00 2388.00 2402.92
12.2657 49.00 2439.00 2400.10
12.2832 50.00 2527.00 2397.29
12.3006 49.00 2401.00 2394.48
12.3181 49.00 2404.00 2391.67
12.3355 48.00 2312.00 2388.87
12.3529 48.00 2306.00 2386.07
12.3704 50.00 2466.00 2383.28
12.3878 48.00 2330.00 2380.49
12.4053 48.00 2320.00 2377.70
12.4227 48.00 2329.00 2374.92
12.4401 50.00 2453.00 2372.15
12.4576 49.00 2417.00 2369.37
12.4750 50.00 2485.00 2366.61
12.4925 48.00 2347.00 2363.84
12.5099 49.00 2362.00 2361.08
12.5273 49.00 2355.00 2358.33
12.5448 49.00 2361.00 2355.58
12.5622 48.00 2333.00 2352.83
12.5797 49.00 2367.00 2350.09
12.5971 49.00 2379.00 2347.35
12.6145 48.00 2323.00 2344.62
12.6320 48.00 2321.00 2341.89
12.6494 48.00 2274.00 2339.16
12.6669 48.00 2349.00 2336.44
12.6843 49.00 2375.00 2333.73
12.7017 49.00 2429.00 2331.01
12.7192 48.00 2319.00 2328.31
12.7366 49.00 2355.00 2325.60
12.7541 48.00 2298.00 2322.90
12.7715 48.00 2333.00 2320.21
12.7889 48.00 2306.00 2317.51
12.8064 48.00 2314.00 2314.83
12.8238 49.00 2355.00 2312.14
12.8413 49.00 2356.00 2309.46
12.8587 48.00 2333.00 2306.79
12.8761 48.00 2275.00 2304.12
12.8936 47.00 2242.00 2301.45
12.9110 49.00 2379.00 2298.79
12.9284 48.00 2260.00 2296.13
12.9459 48.00 2272.00 2293.48
12.9633 48.00 2283.00 2290.83
12.9808 47.00 2207.00 2288.18
12.9982 48.00 2313.00 2285.54
13.0156 48.00 2289.00 2282.90
13.0331 47.00 2241.00 2280.27
13.0505 48.00 2288.00 2277.64
13.0680 48.00 2306.00 2275.01
13.0854 47.00 2219.00 2272.39
13.1028 47.00 2248.00 2269.77
13.1203 47.00 2185.00 2267.16
13.1377 47.00 2242.00 2264.55
13.1552 48.00 2349.00 2261.95
13.1726 48.00 2333.00 2259.35
13.1900 47.00 2222.00 2256.75
13.2075 47.00 2188.00 2254.16
13.2249 47.00 2216.00 2251.57
13.2424 47.00 2245.00 2248.98
13.2598 48.00 2265.00 2246.40
13.2772 47.00 2249.00 2243.82
13.2947 47.00 2242.00 2241.25
13.3121 47.00 2202.00 2238.68
13.3296 48.00 2259.00 2236.11
13.3470 48.00 2313.00 2233.55
13.3644 47.00 2240.00 2231.00
13.3819 47.00 2220.00 2228.44
13.3993 47.00 2235.00 2225.89
13.4168 48.00 2269.00 2223.35
13.4342 47.00 2206.00 2220.81
13.4516 47.00 2173.00 2218.27
13.4691 47.00 2207.00 2215.74
13.4865 47.00 2171.00 2213.21
13.5040 47.00 2196.00 2210.68
13.5214 47.00 2250.00 2208.16
13.5388 47.00 2188.00 2205.64
13.5563 47.00 2208.00 2203.13
13.5737 47.00 2172.00 2200.62
13.5912 47.00 2247.00 2198.11
13.6086 47.00 2173.00 2195.61
13.6260 47.00 2231.00 2193.11
13.6435 47.00 2183.00 2190.61
13.6609 46.00 2157.00 2188.12
13.6784 47.00 2206.00 2185.64
13.6958 47.00 2192.00 2183.15
13.7132 47.00 2173.00 2180.67
13.7307 48.00 2259.00 2178.20
13.7481 47.00 2172.00 2175.73
13.7655 47.00 2210.00 2173.26
13.7830 47.00 2165.00 2170.80
13.8004 48.00 2275.00 2168.34
13.8179 46.00 2118.00 2165.88
13.8353 47.00 2164.00 2163.43
13.8527 47.00 2184.00 2160.98
13.8702 47.00 2189.00 2158.53
13.8876 47.00 2195.00 2156.09
13.9051 46.00 2127.00 2153.65
13.9225 47.00 2208.00 2151.22
13.9399 46.00 2124.00 2148.79
13.9574 46.00 2138.00 2146.36
13.9748 47.00 2212.00 2143.94
13.9923 46.00 2097.00 2141.52
14.0097 46.00 2118.00 2139.11
14.0271 46.00 2140.00 2136.70
14.0446 47.00 2207.00 2134.29
14.0620 45.00 2067.00 2131.89
14.0795 46.00 2084.00 2129.49
14.0969 47.00 2163.00 2127.09
14.1143 46.00 2095.00 2124.70
14.1318 46.00 2097.00 2122.31
14.1492 45.00 2062.00 2119.92
14.1666 47.00 2202.00 2117.54
14.1841 46.00 2162.00 2115.16
14.2015 46.00 2112.00 2112.79
14.2190 46.00 2102.00 2110.42
14.2364 46.00 2089.00 2108.05
14.2538 46.00 2122.00 2105.69
14.2713 46.00 2090.00 2103.33
14.2887 46.00 2084.00 2100.97
14.3062 45.00 2026.00 2098.62
14.3236 46.00 2072.00 2096.27
14.3411 47.00 2197.00 2093.93
14.3585 45.00 1990.00 2091.58
14.3759 46.00 2140.00 2089.25
14.3934 46.00 2102.00 2086.91
14.4108 45.00 2014.00 2084.58
14.4283 46.00 2071.00 2082.26
14.4457 45.00 2005.00 2079.93
14.4631 46.00 2120.00 2077.61
14.4806 46.00 2105.00 2075.30
14.4980 46.00 2071.00 2072.98
14.5154 46.00 2075.00 2070.67
14.5329 46.00 2140.00 2068.37
14.5503 46.00 2078.00 2066.07
14.5678 46.00 2112.00 2063.77
14.5852 46.00 2150.00 2061.47
14.6026 46.00 2098.00 2059.18
14.6201 46.00 2127.00 2056.89
14.6375 46.00 2114.00 2054.61
14.6550 44.00 1970.00 2052.33
14.6724 44.00 1980.00 2050.05
14.6898 46.00 2095.00 2047.78
14.7073 45.00 2011.00 2045.51
14.7247 44.00 1949.00 2043.24
14.7422 45.00 1995.00 2040.98
14.7596 45.00 1991.00 2038.72
14.7770 45.00 2011.00 2036.46
14.7945 44.00 1962.00 2034.21
14.8119 45.00 2028.00 2031.96
14.8294 45.00 2028.00 2029.71
14.8468 45.00 2054.00 2027.47
14.8642 45.00 2040.00 2025.23
14.8817 44.00 1975.00 2023.00
14.8991 45.00 2015.00 2020.77
14.9165 45.00 2054.00 2018.54
14.9340 45.00 2022.00 2016.31
14.9514 45.00 2047.00 2014.09
14.9689 45.00 2057.00 2011.87
14.9863 45.00 2049.00 2009.66
15.0037 44.00 1930.00 2007.45
15.0212 44.00 1971.00 2005.24
15.0386 44.00 1977.00 2003.03
15.0561 45.00 2061.00 2000.83
15.0735 44.00 1913.00 1998.63
15.0909 45.00 2059.00 1996.44
15.1084 44.00 1940.00 1994.25
15.1258 44.00 1963.00 1992.06
15.1433 44.00 1970.00 1989.88
15.1607 45.00 2018.00 1987.70
15.1781 44.00 1971.00 1985.52
15.1956 44.00 1927.00 1983.34
15.2130 44.00 1916.00 1981.17
15.2305 44.00 1952.00 1979.01
15.2479 45.00 1990.00 1976.84
15.2653 43.00 1876.00 1974.68
15.2828 44.00 1931.00 1972.52
15.3002 45.00 2003.00 1970.37
15.3177 45.00 2016.00 1968.22
15.3351 45.00 1996.00 1966.07
15.3525 44.00 1927.00 1963.93
15.3700 44.00 1973.00 1961.78
15.3874 44.00 1962.00 1959.65
15.4049 45.00 1983.00 1957.51
15.4223 44.00 1936.00 1955.38
15.4397 44.00 1924.00 1953.25
15.4572 44.00 1928.00 1951.13
15.4746 44.00 1925.00 1949.01
15.4921 44.00 1977.00 1946.89
15.5095 44.00 1945.00 1944.77
15.5269 43.00 1871.00 1942.66
15.5444 44.00 1927.00 1940.55
15.5618 44.00 1914.00 1938.45
15.5793 44.00 1975.00 1936.35
15.5967 43.00 1850.00 1934.25
15.6141 44.00 1894.00 1932.15
15.6316 44.00 1966.00 1930.06
15.6490 44.00 1919.00 1927.97
15.6664 43.00 1843.00 1925.89
15.6839 44.00 1909.00 1923.80
15.7013 43.00 1885.00 1921.72
15.7188 44.00 1894.00 1919.65
15.7362 44.00 1926.00 1917.57
15.7536 43.00 1892.00 1915.50
15.7711 44.00 1917.00 1913.44
15.7885 43.00 1834.00 1911.37
15.8060 43.00 1819.00 1909.50
15.8234 43.00 1869.00 1907.45
15.8408 44.00 1914.00 1905.50
15.8583 44.00 1924.00 1903.47
15.8757 44.00 1899.00 1901.44
15.8932 44.00 1921.00 1899.42
15.9106 43.00 1878.00 1897.40
15.9280 44.00 1920.00 1895.39
15.9455 43.00 1813.00 1893.39
15.9629 44.00 1932.00 1891.39
15.9804 44.00 1944.00 1889.40
15.9978 44.00 1896.00 1887.42
16.0152 44.00 1949.00 1885.44
16.0327 42.00 1806.00 1883.48
16.0501 42.00 1773.00 1881.53
16.0676 43.00 1827.00 1879.60
16.0850 43.00 1851.00 1877.68
16.1024 43.00 1825.00 1875.79
16.1199 42.00 1737.00 1873.92
16.1373 43.00 1879.00 1872.08
16.1548 44.00 1903.00 1870.27
16.1722 43.00 1885.00 1868.50
16.1896 44.00 1900.00 1866.78
16.2071 43.00 1864.00 1865.14
16.2245 43.00 1815.00 1863.61
16.2419 43.00 1864.00 1862.24
16.2594 43.00 1880.00 1861.12
16.2768 44.00 1930.00 1860.41
16.2943 43.00 1836.00 1860.40
16.3117 42.00 1770.00 1861.67
16.3291 44.00 1898.00 1865.28
16.3466 43.00 1876.00 1872.88
16.3640 43.00 1837.00 1886.17
16.3815 43.00 1863.00 1904.84
16.3989 44.00 1900.00 1923.71
16.4163 43.00 1881.00 1932.47
16.4338 44.00 1921.00 1925.38
16.4512 43.00 1830.00 1908.14
16.4687 43.00 1822.00 1886.60
16.4861 43.00 1888.00 1866.09
16.5035 43.00 1824.00 1850.66
16.5210 43.00 1811.00 1840.54
16.5384 42.00 1767.00 1834.11
16.5558 43.00 1871.00 1829.73
16.5733 42.00 1734.00 1826.37
16.5907 42.00 1765.00 1823.50
16.6082 43.00 1820.00 1820.91
16.6256 42.00 1802.00 1818.49
16.6430 43.00 1845.00 1816.19
16.6605 42.00 1743.00 1813.98
16.6779 43.00 1807.00 1811.83
16.6954 42.00 1789.00 1809.72
16.7128 42.00 1746.00 1807.65
16.7302 42.00 1755.00 1805.60
16.7477 43.00 1838.00 1803.58
16.7651 42.00 1783.00 1801.58
16.7826 42.00 1779.00 1799.61
16.8000 42.00 1806.00 1797.65
16.8174 42.00 1737.00 1795.70
16.8349 42.00 1769.00 1793.77
16.8523 42.00 1796.00 1791.84
16.8698 42.00 1806.00 1789.92
16.8872 42.00 1796.00 1788.01
16.9046 43.00 1835.00 1786.11
16.9221 41.00 1712.00 1784.21
16.9395 42.00 1769.00 1782.32
16.9570 42.00 1789.00 1780.43
16.9744 42.00 1781.00 1778.55
16.9918 42.00 1730.00 1776.68
17.0093 41.00 1666.00 1774.80
17.0267 43.00 1818.00 1772.93
17.0442 42.00 1775.00 1770.91
17.0616 42.00 1755.00 1769.06
17.0790 42.00 1782.00 1767.13
17.0965 42.00 1766.00 1765.29
17.1139 42.00 1796.00 1763.46
17.1313 41.00 1696.00 1761.62
17.1488 41.00 1693.00 1759.79
17.1662 42.00 1763.00 1757.96
17.1837 42.00 1740.00 1756.14
17.2011 42.00 1785.00 1754.31
17.2185 42.00 1782.00 1752.49
17.2360 43.00 1820.00 1750.68
17.2534 42.00 1796.00 1748.86
17.2709 42.00 1764.00 1747.05
17.2883 42.00 1780.00 1745.24
17.3057 42.00 1799.00 1743.44
17.3232 42.00 1767.00 1741.63
17.3406 41.00 1672.00 1739.83
17.3581 42.00 1790.00 1738.03
17.3755 42.00 1757.00 1736.24
17.3929 41.00 1710.00 1734.45
17.4104 42.00 1728.00 1732.66
17.4278 42.00 1803.00 1730.87
17.4453 42.00 1733.00 1729.09
17.4627 42.00 1730.00 1727.30
17.4801 42.00 1730.00 1725.52
17.4976 42.00 1741.00 1723.75
17.5150 41.00 1674.00 1721.98
17.5325 41.00 1652.00 1720.20
17.5499 42.00 1731.00 1718.44
17.5673 41.00 1695.00 1716.67
17.5848 41.00 1679.00 1714.91
17.6022 42.00 1743.00 1713.15
17.6197 41.00 1679.00 1711.39
17.6371 42.00 1748.00 1709.64
17.6545 41.00 1668.00 1707.88
17.6720 41.00 1656.00 1706.13
17.6894 42.00 1759.00 1704.39
17.7069 41.00 1689.00 1702.64
17.7243 42.00 1749.00 1700.90
17.7417 41.00 1680.00 1699.16
17.7592 41.00 1714.00 1697.43
17.7766 41.00 1708.00 1695.69
17.7941 41.00 1649.00 1693.96
17.8115 41.00 1710.00 1692.24
17.8289 41.00 1710.00 1690.51
17.8464 43.00 1820.00 1688.79
17.8638 42.00 1739.00 1687.12
17.8812 41.00 1652.00 1685.40
17.8987 42.00 1730.00 1683.69
17.9161 42.00 1749.00 1682.01
17.9336 40.00 1626.00 1680.31
17.9510 40.00 1621.00 1678.61
17.9684 40.00 1640.00 1676.91
17.9859 41.00 1652.00 1675.21
18.0033 42.00 1725.00 1673.52
18.0208 41.00 1658.00 1671.84
18.0382 41.00 1653.00 1670.15
18.0556 41.00 1678.00 1668.47
18.0731 41.00 1696.00 1666.80
18.0905 40.00 1614.00 1665.13
18.1080 40.00 1636.00 1663.46
18.1254 40.00 1610.00 1661.80
18.1428 41.00 1665.00 1660.15
18.1603 41.00 1710.00 1658.51
18.1777 41.00 1663.00 1656.88
18.1952 42.00 1728.00 1655.25
18.2126 40.00 1607.00 1653.64
18.2300 41.00 1690.00 1652.03
18.2475 40.00 1614.00 1650.45
18.2649 41.00 1716.00 1648.89
18.2824 41.00 1658.00 1647.36
18.2998 42.00 1724.00 1645.88
18.3172 41.00 1686.00 1644.47
18.3347 41.00 1655.00 1643.17
18.3521 41.00 1704.00 1642.07
18.3696 41.00 1657.00 1641.34
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18.4044 41.00 1667.00 1642.41
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18.4393 41.00 1678.00 1649.40
18.4567 41.00 1714.00 1653.45
18.4742 41.00 1716.00 1654.39
18.4916 42.00 1754.00 1651.12
18.5091 42.00 1752.00 1645.57
18.5265 41.00 1643.00 1639.01
18.5439 41.00 1666.00 1632.39
18.5614 41.00 1712.00 1626.87
18.5788 40.00 1637.00 1622.76
18.5963 40.00 1622.00 1619.73
18.6137 41.00 1656.00 1617.34
18.6311 40.00 1628.00 1615.28
18.6486 39.00 1557.00 1613.39
18.6660 40.00 1579.00 1611.58
18.6835 40.00 1637.00 1609.83
18.7009 41.00 1645.00 1608.11
18.7183 40.00 1615.00 1606.43
18.7358 40.00 1625.00 1604.76
18.7532 41.00 1659.00 1603.11
18.7707 41.00 1665.00 1601.47
18.7881 40.00 1611.00 1599.83
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18.8230 41.00 1649.00 1596.60
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18.9102 39.00 1512.00 1588.63
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18.9625 40.00 1583.00 1583.90
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18.9974 41.00 1646.00 1580.76
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19.1369 40.00 1562.00 1568.26
19.1543 40.00 1585.00 1566.72
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19.2066 39.00 1550.00 1562.12
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19.5031 40.00 1603.00 1536.44
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19.5554 39.00 1544.00 1531.97
19.5729 39.00 1558.00 1530.49
19.5903 39.00 1550.00 1529.01
19.6077 39.00 1538.00 1527.53
19.6252 39.00 1545.00 1526.05
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19.6601 40.00 1580.00 1523.11
19.6775 39.00 1555.00 1521.63
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19.7124 40.00 1570.00 1518.70
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19.8693 39.00 1484.00 1505.60
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19.9216 39.00 1509.00 1501.28
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19.9565 39.00 1513.00 1498.40
19.9740 39.00 1510.00 1496.97
19.9914 39.00 1553.00 1495.54
20.0088 38.00 1442.00 1494.11
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20.0786 38.00 1481.00 1488.41
20.0960 40.00 1561.00 1486.99
20.1135 39.00 1550.00 1485.58
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20.1483 40.00 1588.00 1482.75
20.1658 40.00 1568.00 1481.34
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20.2355 39.00 1512.00 1475.72
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20.2704 38.00 1468.00 1472.92
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20.3053 38.00 1475.00 1470.13
20.3228 38.00 1481.00 1468.74
20.3402 39.00 1501.00 1467.35
20.3576 38.00 1416.00 1465.96
20.3751 37.00 1394.00 1464.58
20.3925 37.00 1384.00 1463.20
20.4099 38.00 1414.00 1461.81
20.4274 38.00 1464.00 1460.44
20.4448 38.00 1473.00 1459.06
20.4623 39.00 1529.00 1457.68
20.4797 38.00 1433.00 1456.31
20.4971 39.00 1534.00 1454.94
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128.9060 27.00 720.00 663.84
128.9234 26.00 694.00 677.78
128.9408 27.00 717.00 691.98
128.9583 27.00 729.00 706.28
128.9757 27.00 746.00 720.32
128.9931 27.00 756.00 733.48
129.0106 27.00 729.00 744.92
129.0280 27.00 756.00 753.67
129.0455 28.00 770.00 758.83
129.0629 27.00 740.00 759.80
129.0803 27.00 731.00 756.39
129.0978 27.00 746.00 748.71
129.1152 26.00 692.00 737.18
129.1326 27.00 723.00 722.43
129.1501 27.00 732.00 705.27
129.1675 26.00 664.00 686.64
129.1849 26.00 665.00 667.55
129.2024 25.00 608.00 648.88
129.2198 25.00 627.00 631.40
129.2372 25.00 623.00 615.51
129.2547 25.00 604.00 601.58
129.2721 25.00 619.00 589.71
129.2896 25.00 612.00 579.97
129.3070 24.00 568.00 572.28
129.3244 24.00 577.00 566.56
129.3419 23.00 551.00 562.68
129.3593 23.00 548.00 560.57
129.3767 24.00 567.00 560.14
129.3942 24.00 557.00 561.35
129.4116 25.00 622.00 564.15
129.4291 25.00 619.00 568.51
129.4465 24.00 576.00 574.36
129.4639 24.00 576.00 581.59
129.4814 24.00 584.00 590.00
129.4988 24.00 558.00 599.32
129.5162 25.00 625.00 609.15
129.5337 25.00 638.00 619.03
129.5511 26.00 658.00 628.44
129.5685 25.00 650.00 636.88
129.5860 24.00 569.00 643.92
129.6034 26.00 679.00 649.22
129.6208 24.00 600.00 652.49
129.6383 26.00 665.00 653.58
129.6557 26.00 664.00 652.43
129.6732 25.00 631.00 649.10
129.6906 25.00 640.00 643.76
129.7080 25.00 604.00 636.66
129.7255 25.00 601.00 628.12
129.7429 25.00 605.00 618.49
129.7603 23.00 532.00 608.19
129.7778 24.00 570.00 597.63
129.7952 25.00 606.00 587.20
129.8127 23.00 548.00 577.23
129.8301 24.00 583.00 569.21
129.8475 24.00 569.00 560.89
129.8649 23.00 551.00 553.56
129.8824 24.00 570.00 547.25
129.8998 23.00 525.00 541.64
129.9173 24.00 557.00 537.31
129.9347 24.00 555.00 533.87
129.9521 23.00 527.00 531.24
129.9696 23.00 521.00 529.21
129.9870 23.00 545.00 528.74
130.0044 22.00 504.00 528.19
130.0219 23.00 510.00 528.20
loop_
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loop_
_pd_proc_wavelength
1.540562
1.544390
