#------------------------------------------------------------------------------
#$Date: 2025-08-21 03:19:08 +0300 (Thu, 21 Aug 2025) $
#$Revision: 301842 $
#$URL: file:///home/coder/svn-repositories/cod/cif/4/50/19/4501927.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_4501927
loop_
_publ_author_name
'Lim, Gin Keat'
'Zhou, Zhongfu'
'Fujii, Kotaro'
'Calcagno, Patrizia'
'Tedesco, Emilio'
'Kitchin, Simon J.'
'Kariuki, Benson M.'
'Philp, Douglas'
'Harris, Kenneth D. M.'
_publ_section_title
;
 Arrays of P═O Dipoles As a Recurrent Structural Motif in
 Bis-Diphenylphosphine Oxides, Established from Powder X-ray Diffraction
;
_journal_issue                   8
_journal_name_full               'Crystal Growth & Design'
_journal_page_first              3814
_journal_paper_doi               10.1021/cg100715v
_journal_volume                  10
_journal_year                    2010
_chemical_formula_sum            'C29 H30 O2 P2'
_chemical_formula_weight         472.50
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_audit_creation_date             2009-04-16T17:58
_audit_creation_method           'from EXP file using GSAS2CIF'
_audit_update_record
' 2009-04-16T17:58  Initial CIF as created by GSAS2CIF'
_cell_angle_alpha                75.0714(24)
_cell_angle_beta                 83.8700(28)
_cell_angle_gamma                82.9981(25)
_cell_formula_units_Z            2
_cell_length_a                   5.79864(11)
_cell_length_b                   14.5148(5)
_cell_length_c                   15.7060(4)
_cell_volume                     1263.85(6)
_computing_structure_refinement  GSAS
_diffrn_radiation_polarisn_ratio 0.55
_diffrn_radiation_probe          x-ray
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  1.00000
_exptl_absorpt_process_details
;   GSAS Absorption/surface roughness correction: function number 0
 No correction is applied.
;
_pd_block_id                     2009-04-16T17:58|PO5||
_pd_calc_method                  'Rietveld Refinement'
_pd_instr_location               ' ?'
_pd_meas_2theta_range_inc        0.0192
_pd_meas_2theta_range_max        59.7008
_pd_meas_2theta_range_min        5.0
_pd_meas_number_of_points        2850
_pd_phase_name                   'from C:/Users/kotarokf/Desktop/PO5/PO5+H.cif'
_pd_proc_2theta_range_inc        0.0192
_pd_proc_2theta_range_max        59.66897
_pd_proc_2theta_range_min        4.96817
_pd_proc_info_datetime           2009-04-16T17:58:44
_pd_proc_info_excluded_regions   ' ?'
_pd_proc_ls_background_function
;   GSAS Background function number 7 with 36 terms.
 Linear interpolation
      1:    2344.72     2:    2477.56     3:    2606.55     4:    2510.44    
      5:    2305.39     6:    2149.20     7:    2187.97     8:    2271.21    
      9:    2397.53    10:    2302.17    11:    2363.93    12:    2103.27    
     13:    1714.99    14:    1537.31    15:    1466.65    16:    1295.82    
     17:    1025.69    18:    1048.63    19:    901.340    20:    864.267    
     21:    804.261    22:    815.924    23:    801.081    24:    798.512    
     25:    738.131    26:    704.733    27:    701.724    28:    639.857    
     29:    661.632    30:    567.223    31:    553.872    32:    530.687    
     33:    491.823    34:    453.030    35:    437.870    36:    416.985    
;
_pd_proc_ls_peak_cutoff          0.01000
_pd_proc_ls_pref_orient_corr
;   March-Dollase
 AXIS  1 Ratio=   0.91137  h= 1.000  k= 1.000  l= 0.000
 Prefered orientation correction range: Min=   0.87006, Max=   1.32101
;
_pd_proc_ls_profile_function
;
 CW Profile function number 2 with  18 terms
 Profile coefficients for Simpson's rule integration of pseudovoigt function
 C.J. Howard (1982). J. Appl. Cryst.,15,615-620.
 P. Thompson, D.E. Cox & J.B. Hastings (1987). J. Appl. Cryst.,20,79-83.
 Peak tails are ignored  where the intensity is below 0.0100 times the peak
   Aniso. broadening axis   0.0   0.0   1.0
;
_pd_proc_ls_prof_R_factor        0.0270
_pd_proc_ls_prof_wR_expected     0.0249
_pd_proc_ls_prof_wR_factor       0.0398
_pd_proc_number_of_points        2850
_pd_spec_mounting                ' ?'
_refine_ls_goodness_of_fit_all   1.65
_refine_ls_matrix_type           full
_refine_ls_number_parameters     234
_refine_ls_number_restraints     216
_refine_ls_R_Fsqd_factor         0.11831
_refine_ls_shift/su_max          0.10
_refine_ls_shift/su_mean         0.01
_reflns_d_resolution_high        1.547
_reflns_d_resolution_low         15.129
_reflns_limit_h_max              3
_reflns_limit_h_min              0
_reflns_limit_k_max              9
_reflns_limit_k_min              -8
_reflns_limit_l_max              10
_reflns_limit_l_min              -9
_reflns_number_total             1436
_cod_data_source_file            cg100715v_si_002.cif
_cod_data_source_block           PO5_publ
_cod_depositor_comments
;
The following automatic conversions were performed:

'_geom_bond_publ_flag' value 'N' changed to 'n' according to
/home/saulius/struct/CIF-dictionaries/cif_core.dic dictionary named
'cif_core.dic' version 2.4.2 from 2011-04-26 (265
times).

'_geom_angle_publ_flag' value 'N' changed to 'n' according
to /home/saulius/struct/CIF-dictionaries/cif_core.dic dictionary
named 'cif_core.dic' version 2.4.2 from 2011-04-26 (114 times).

Automatic conversion script
Id: cif_fix_values 1715 2011-07-08 13:25:40Z adriana 
;
_cod_original_cell_volume        1263.85(4)
_cod_database_code               4501927
#BEGIN Tags that were not found in dictionaries:
_gsas_exptl_extinct_corr_t_min   1.00000
_gsas_exptl_extinct_corr_t_max   1.00000
#END Tags that were not found in dictionaries
loop_
_symmetry_equiv_pos_site_id
_symmetry_equiv_pos_as_xyz
1 +x,+y,+z
-1 -x,-y,-z
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
P P1 0.8895(12) 0.78499(24) 0.7223(4) 1.0 Uiso 0.0884(33) 2
O O2 1.1473(13) 0.7621(8) 0.7158(8) 1.0 Uiso 0.0884(33) 2
C C3 0.7728(15) 0.76402(21) 0.8365(5) 1.0 Uiso 0.0884(33) 2
C C4 0.5560(16) 0.72986(26) 0.8607(7) 1.0 Uiso 0.0884(33) 2
C C5 0.4645(21) 0.71352(29) 0.9482(8) 1.0 Uiso 0.0884(33) 2
C C6 0.5898(28) 0.73147(23) 1.0116(6) 1.0 Uiso 0.0884(33) 2
C C7 0.8063(26) 0.76564(24) 0.9876(5) 1.0 Uiso 0.0884(33) 2
C C8 0.8979(19) 0.78193(25) 0.9002(6) 1.0 Uiso 0.0884(33) 2
C C9 0.8167(12) 0.90801(34) 0.6642(4) 1.0 Uiso 0.0884(33) 2
C C10 0.9825(12) 0.9580(7) 0.6064(4) 1.0 Uiso 0.0884(33) 2
C C11 0.9268(18) 1.0525(7) 0.5617(5) 1.0 Uiso 0.0884(33) 2
C C12 0.7053(21) 1.0970(4) 0.5749(6) 1.0 Uiso 0.0884(33) 2
C C13 0.5395(16) 1.0472(6) 0.6326(6) 1.0 Uiso 0.0884(33) 2
C C14 0.5951(12) 0.9526(6) 0.6773(4) 1.0 Uiso 0.0884(33) 2
C C15 0.7323(18) 0.7155(8) 0.6724(6) 1.0 Uiso 0.0884(33) 2
C C16 0.8688(27) 0.6996(17) 0.5872(8) 1.0 Uiso 0.0884(33) 2
C C17 0.7474(27) 0.6315(9) 0.5507(5) 1.0 Uiso 0.0884(33) 2
C C18 0.8859(28) 0.6153(7) 0.4663(4) 1.0 Uiso 0.0884(33) 2
C C19 0.7701(17) 0.6780(8) 0.3850(5) 1.0 Uiso 0.0884(33) 2
P P20 0.9785(13) 0.69114(29) 0.29041(19) 1.0 Uiso 0.0884(33) 2
O O21 1.2231(16) 0.6828(8) 0.3145(8) 1.0 Uiso 0.0884(33) 2
C C22 0.8945(15) 0.8080(4) 0.22033(17) 1.0 Uiso 0.0884(33) 2
C C23 1.0489(18) 0.8778(6) 0.20061(21) 1.0 Uiso 0.0884(33) 2
C C24 0.9864(27) 0.9674(6) 0.14702(19) 1.0 Uiso 0.0884(33) 2
C C25 0.7699(28) 0.9875(5) 0.11303(23) 1.0 Uiso 0.0884(33) 2
C C26 0.6156(20) 0.9181(7) 0.13248(28) 1.0 Uiso 0.0884(33) 2
C C27 0.6775(15) 0.8283(6) 0.18615(22) 1.0 Uiso 0.0884(33) 2
C C28 0.9293(15) 0.60317(28) 0.2322(4) 1.0 Uiso 0.0884(33) 2
C C29 0.7346(15) 0.5522(4) 0.2546(7) 1.0 Uiso 0.0884(33) 2
C C30 0.7002(21) 0.48523(32) 0.2089(9) 1.0 Uiso 0.0884(33) 2
C C31 0.8606(27) 0.4691(4) 0.1410(8) 1.0 Uiso 0.0884(33) 2
C C32 1.0547(25) 0.5197(5) 0.1185(5) 1.0 Uiso 0.0884(33) 2
C C33 1.0893(17) 0.5866(4) 0.1640(4) 1.0 Uiso 0.0884(33) 2
H H34 0.4671(17) 0.71712(34) 0.8160(9) 1.0 Uiso 0.120(5) 2
H H35 0.3113(22) 0.6893(4) 0.9651(11) 1.0 Uiso 0.120(5) 2
H H36 0.5253(35) 0.71994(25) 1.0733(6) 1.0 Uiso 0.120(5) 2
H H37 0.8951(33) 0.77834(31) 1.0323(7) 1.0 Uiso 0.120(5) 2
H H38 1.0511(19) 0.80614(31) 0.8834(8) 1.0 Uiso 0.120(5) 2
H H39 1.1392(12) 0.9265(9) 0.5970(5) 1.0 Uiso 0.120(5) 2
H H40 1.0441(22) 1.0878(10) 0.5208(5) 1.0 Uiso 0.120(5) 2
H H41 0.6659(28) 1.1638(5) 0.5433(8) 1.0 Uiso 0.120(5) 2
H H42 0.3829(18) 1.0787(9) 0.6419(8) 1.0 Uiso 0.120(5) 2
H H43 0.4778(13) 0.9173(9) 0.7183(4) 1.0 Uiso 0.120(5) 2
H H44 0.5793(21) 0.7497(17) 0.6583(17) 1.0 Uiso 0.120(5) 2
H H45 0.711(4) 0.6533(14) 0.7138(6) 1.0 Uiso 0.120(5) 2
H H46 1.0276(16) 0.671(4) 0.6000(20) 1.0 Uiso 0.120(5) 2
H H47 0.875(8) 0.7611(24) 0.5432(6) 1.0 Uiso 0.120(5) 2
H H48 0.740(6) 0.5702(11) 0.5949(5) 1.0 Uiso 0.120(5) 2
H H49 0.5892(19) 0.6599(21) 0.5372(9) 1.0 Uiso 0.120(5) 2
H H50 1.0453(22) 0.6320(16) 0.4649(6) 1.0 Uiso 0.120(5) 2
H H51 0.890(5) 0.5477(6) 0.4658(6) 1.0 Uiso 0.120(5) 2
H H52 0.7156(33) 0.7412(9) 0.3951(6) 1.0 Uiso 0.120(5) 2
H H53 0.6376(21) 0.6476(17) 0.3744(9) 1.0 Uiso 0.120(5) 2
H H54 1.2020(18) 0.8637(10) 0.22464(30) 1.0 Uiso 0.120(5) 2
H H55 1.0956(34) 1.0167(8) 0.13319(22) 1.0 Uiso 0.120(5) 2
H H56 0.726(4) 1.0510(5) 0.07512(27) 1.0 Uiso 0.120(5) 2
H H57 0.4626(21) 0.9324(11) 0.1083(4) 1.0 Uiso 0.120(5) 2
H H58 0.5681(17) 0.7791(9) 0.19987(28) 1.0 Uiso 0.120(5) 2
H H59 0.6212(15) 0.5636(5) 0.3026(7) 1.0 Uiso 0.120(5) 2
H H60 0.5629(22) 0.4493(4) 0.2248(12) 1.0 Uiso 0.120(5) 2
H H61 0.8364(34) 0.4218(4) 0.1089(10) 1.0 Uiso 0.120(5) 2
H H62 1.1680(30) 0.5083(7) 0.0705(4) 1.0 Uiso 0.120(5) 2
H H63 1.2269(17) 0.6224(5) 0.1479(6) 1.0 Uiso 0.120(5) 2
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
P 4.0 0.000 0.000 6.43450 1.90670 4.17910 27.1570 1.78000 0.52600 1.49080
68.1645 1.11490 International_Tables_Vol_C
O 4.0 0.000 0.000 3.04850 13.2771 2.28680 5.70110 1.54630 0.32390 0.86700
32.9089 0.25080 International_Tables_Vol_C
C 58.0 0.000 0.000 2.31000 20.8439 1.02000 10.2075 1.58860 0.56870 0.86500
51.6512 0.21560 International_Tables_Vol_C
H 60.0 0.000 0.000 0.49300 10.5109 0.32291 26.1257 0.14019 3.14236 0.04081
57.7997 0.00304 International_Tables_Vol_C
loop_
_diffrn_radiation_wavelength
_diffrn_radiation_wavelength_wt
_diffrn_radiation_type
_diffrn_radiation_wavelength_id
1.540600 1.000 K\a~1~ 1
1.540600 0.500 K\a~2~ 2
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_3
_geom_angle_publ_flag
O2 P1 C3 111.1(4) 1_555 1_555 n
O2 P1 C9 109.5(4) 1_555 1_555 n
O2 P1 C15 114.6(4) 1_555 1_555 n
C3 P1 C9 110.47(26) 1_555 1_555 n
C3 P1 C15 105.81(31) 1_555 1_555 n
C9 P1 C15 105.1(4) 1_555 1_555 n
P1 C3 C4 119.69(31) 1_555 1_555 n
P1 C3 C8 120.72(35) 1_555 1_555 n
C4 C3 C8 119.59(23) 1_555 1_555 n
C3 C4 C5 120.25(16) 1_555 1_555 n
C3 C4 H34 119.87(16) 1_555 1_555 n
C5 C4 H34 119.87(16) 1_555 1_555 n
C4 C5 C6 120.04(18) 1_555 1_555 n
C4 C5 H35 120.01(15) 1_555 1_555 n
C6 C5 H35 119.96(17) 1_555 1_555 n
C5 C6 C7 119.80(18) 1_555 1_555 n
C5 C6 H36 120.03(15) 1_555 1_555 n
C7 C6 H36 120.17(15) 1_555 1_555 n
C6 C7 C8 120.19(15) 1_555 1_555 n
C6 C7 H37 119.90(17) 1_555 1_555 n
C8 C7 H37 119.92(17) 1_555 1_555 n
C3 C8 C7 120.13(18) 1_555 1_555 n
C3 C8 H38 119.91(17) 1_555 1_555 n
C7 C8 H38 119.96(15) 1_555 1_555 n
P1 C9 C10 120.0(4) 1_555 1_555 n
P1 C9 C14 120.1(4) 1_555 1_555 n
C10 C9 C14 119.93(22) 1_555 1_555 n
C9 C10 C11 120.01(19) 1_555 1_555 n
C9 C10 H39 119.99(15) 1_555 1_555 n
C11 C10 H39 120.01(15) 1_555 1_555 n
C10 C11 C12 120.05(17) 1_555 1_555 n
C10 C11 H40 119.97(16) 1_555 1_555 n
C12 C11 H40 119.99(16) 1_555 1_555 n
C11 C12 C13 120.03(17) 1_555 1_555 n
C11 C12 H41 120.01(15) 1_555 1_555 n
C13 C12 H41 119.96(15) 1_555 1_555 n
C12 C13 C14 119.98(17) 1_555 1_555 n
C12 C13 H42 120.01(15) 1_555 1_555 n
C14 C13 H42 120.02(15) 1_555 1_555 n
C9 C14 C13 120.01(18) 1_555 1_555 n
C9 C14 H43 119.97(16) 1_555 1_555 n
C13 C14 H43 120.01(16) 1_555 1_555 n
P1 C15 C16 110.0(4) 1_555 1_555 n
P1 C15 H44 109.38(18) 1_555 1_555 n
P1 C15 H45 109.4(5) 1_555 1_555 n
C16 C15 H44 109.40(18) 1_555 1_555 n
C16 C15 H45 109.37(28) 1_555 1_555 n
H44 C15 H45 109.29(21) 1_555 1_555 n
C15 C16 C17 109.6(4) 1_555 1_555 n
C15 C16 H46 109.52(20) 1_555 1_555 n
C15 C16 H47 109.5(6) 1_555 1_555 n
C17 C16 H46 109.42(21) 1_555 1_555 n
C17 C16 H47 109.3(7) 1_555 1_555 n
H46 C16 H47 109.49(19) 1_555 1_555 n
C16 C17 C18 109.2(4) 1_555 1_555 n
C16 C17 H48 109.4(4) 1_555 1_555 n
C16 C17 H49 109.50(23) 1_555 1_555 n
C18 C17 H48 109.6(5) 1_555 1_555 n
C18 C17 H49 109.57(24) 1_555 1_555 n
H48 C17 H49 109.54(21) 1_555 1_555 n
C17 C18 C19 109.92(34) 1_555 1_555 n
C17 C18 H50 109.4(4) 1_555 1_555 n
C17 C18 H51 109.39(33) 1_555 1_555 n
C19 C18 H50 109.36(25) 1_555 1_555 n
C19 C18 H51 109.38(20) 1_555 1_555 n
H50 C18 H51 109.39(20) 1_555 1_555 n
C18 C19 P20 109.28(31) 1_555 1_555 n
C18 C19 H52 109.55(21) 1_555 1_555 n
C18 C19 H53 109.52(21) 1_555 1_555 n
P20 C19 H52 109.46(22) 1_555 1_555 n
P20 C19 H53 109.44(34) 1_555 1_555 n
H52 C19 H53 109.57(30) 1_555 1_555 n
C19 P20 O21 112.7(4) 1_555 1_555 n
C19 P20 C22 104.98(34) 1_555 1_555 n
C19 P20 C28 106.8(4) 1_555 1_555 n
O21 P20 C22 111.7(4) 1_555 1_555 n
O21 P20 C28 113.1(4) 1_555 1_555 n
C22 P20 C28 107.00(17) 1_555 1_555 n
P20 C22 C23 119.50(33) 1_555 1_555 n
P20 C22 C27 120.66(34) 1_555 1_555 n
C23 C22 C27 119.84(22) 1_555 1_555 n
C22 C23 C24 119.98(17) 1_555 1_555 n
C22 C23 H54 120.04(15) 1_555 1_555 n
C24 C23 H54 119.98(15) 1_555 1_555 n
C23 C24 C25 120.09(16) 1_555 1_555 n
C23 C24 H55 119.92(15) 1_555 1_555 n
C25 C24 H55 119.98(15) 1_555 1_555 n
C24 C25 C26 120.12(17) 1_555 1_555 n
C24 C25 H56 119.92(14) 1_555 1_555 n
C26 C25 H56 119.97(14) 1_555 1_555 n
C25 C26 C27 119.94(16) 1_555 1_555 n
C25 C26 H57 120.00(15) 1_555 1_555 n
C27 C26 H57 120.06(14) 1_555 1_555 n
C22 C27 C26 120.03(18) 1_555 1_555 n
C22 C27 H58 120.04(15) 1_555 1_555 n
C26 C27 H58 119.93(15) 1_555 1_555 n
P20 C28 C29 121.2(4) 1_555 1_555 n
P20 C28 C33 119.31(34) 1_555 1_555 n
C29 C28 C33 119.51(21) 1_555 1_555 n
C28 C29 C30 120.17(19) 1_555 1_555 n
C28 C29 H59 119.86(17) 1_555 1_555 n
C30 C29 H59 119.97(15) 1_555 1_555 n
C29 C30 C31 120.00(17) 1_555 1_555 n
C29 C30 H60 120.11(17) 1_555 1_555 n
C31 C30 H60 119.89(17) 1_555 1_555 n
C30 C31 C32 119.96(17) 1_555 1_555 n
C30 C31 H61 119.98(15) 1_555 1_555 n
C32 C31 H61 120.06(16) 1_555 1_555 n
C31 C32 C33 120.11(18) 1_555 1_555 n
C31 C32 H62 119.90(17) 1_555 1_555 n
C33 C32 H62 119.99(15) 1_555 1_555 n
C28 C33 C32 120.24(18) 1_555 1_555 n
C28 C33 H63 119.86(18) 1_555 1_555 n
C32 C33 H63 119.90(17) 1_555 1_555 n
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
P1 O2 1.4900(33) 1_555 n
P1 C3 1.8113(32) 1_555 n
P1 C9 1.8046(32) 1_555 n
P1 C15 1.8017(32) 1_555 n
P1 H44 2.319(4) 1_555 n
P1 H45 2.319(7) 1_555 n
O2 P1 1.4900(33) 1_555 n
C3 P1 1.8113(32) 1_555 n
C3 C4 1.3870(31) 1_555 n
C3 C8 1.3887(31) 1_555 n
C3 H34 2.0587(32) 1_555 n
C3 H38 2.0605(34) 1_555 n
C4 C3 1.3870(31) 1_555 n
C4 C5 1.3898(31) 1_555 n
C4 H34 0.9800(8) 1_555 n
C4 H35 2.0626(34) 1_555 n
C5 C4 1.3898(31) 1_555 n
C5 C6 1.3868(31) 1_555 n
C5 H34 2.0613(34) 1_555 n
C5 H35 0.9800(8) 1_555 n
C5 H36 2.0601(33) 1_555 n
C6 C5 1.3868(31) 1_555 n
C6 C7 1.3852(31) 1_555 n
C6 H35 2.059(4) 1_555 n
C6 H36 0.9800(8) 1_555 n
C6 H37 2.0573(33) 1_555 n
C7 C6 1.3852(31) 1_555 n
C7 C8 1.3892(31) 1_555 n
C7 H36 2.060(4) 1_555 n
C7 H37 0.9800(8) 1_555 n
C7 H38 2.0616(34) 1_555 n
C8 C3 1.3887(31) 1_555 n
C8 C7 1.3892(31) 1_555 n
C8 H37 2.061(4) 1_555 n
C8 H38 0.9800(8) 1_555 n
C9 P1 1.8046(32) 1_555 n
C9 C10 1.3858(31) 1_555 n
C9 C14 1.3863(31) 1_555 n
C9 H39 2.0588(34) 1_555 n
C9 H43 2.0591(34) 1_555 n
C10 C9 1.3858(31) 1_555 n
C10 C11 1.3860(31) 1_555 n
C10 H39 0.9800(8) 1_555 n
C10 H40 2.0587(34) 1_555 n
C11 C10 1.3860(31) 1_555 n
C11 C12 1.3856(32) 1_555 n
C11 H39 2.0591(34) 1_555 n
C11 H40 0.9800(8) 1_555 n
C11 H41 2.0588(34) 1_555 n
C12 C11 1.3856(32) 1_555 n
C12 C13 1.3836(32) 1_555 n
C12 H40 2.059(4) 1_555 n
C12 H41 0.9800(8) 1_555 n
C12 H42 2.0569(35) 1_555 n
C13 C12 1.3836(32) 1_555 n
C13 C14 1.3880(31) 1_555 n
C13 H41 2.0564(34) 1_555 n
C13 H42 0.9800(8) 1_555 n
C13 H43 2.0610(34) 1_555 n
C14 C9 1.3863(31) 1_555 n
C14 C13 1.3880(31) 1_555 n
C14 H42 2.0610(34) 1_555 n
C14 H43 0.9800(8) 1_555 n
C15 P1 1.8017(32) 1_555 n
C15 C16 1.5347(32) 1_555 n
C15 H44 0.9800(8) 1_555 n
C15 H45 0.9800(8) 1_555 n
C15 H46 2.079(4) 1_555 n
C15 H47 2.078(8) 1_555 n
C16 C15 1.5347(32) 1_555 n
C16 C17 1.5321(32) 1_555 n
C16 H44 2.0773(35) 1_555 n
C16 H45 2.077(5) 1_555 n
C16 H46 0.9800(8) 1_555 n
C16 H47 0.9800(8) 1_555 n
C16 H48 2.075(6) 1_555 n
C16 H49 2.076(4) 1_555 n
C17 C16 1.5321(32) 1_555 n
C17 C18 1.5316(32) 1_555 n
C17 H46 2.075(4) 1_555 n
C17 H47 2.074(9) 1_555 n
C17 H48 0.9800(8) 1_555 n
C17 H49 0.9800(8) 1_555 n
C17 H50 2.074(6) 1_555 n
C17 H51 2.074(5) 1_555 n
C18 C17 1.5316(32) 1_555 n
C18 C19 1.5318(33) 1_555 n
C18 H48 2.076(6) 1_555 n
C18 H49 2.076(4) 1_555 n
C18 H50 0.9800(8) 1_555 n
C18 H51 0.9800(8) 1_555 n
C18 H52 2.076(4) 1_555 n
C18 H53 2.076(4) 1_555 n
C19 C18 1.5318(33) 1_555 n
C19 P20 1.7974(32) 1_555 n
C19 H50 2.074(4) 1_555 n
C19 H51 2.074(4) 1_555 n
C19 H52 0.9800(8) 1_555 n
C19 H53 0.9800(8) 1_555 n
P20 C19 1.7974(32) 1_555 n
P20 O21 1.4895(33) 1_555 n
P20 C22 1.8103(31) 1_555 n
P20 C28 1.8147(32) 1_555 n
P20 H52 2.316(4) 1_555 n
P20 H53 2.316(5) 1_555 n
O21 P20 1.4895(33) 1_555 n
C22 P20 1.8103(31) 1_555 n
C22 C23 1.3867(31) 1_555 n
C22 C27 1.3897(31) 1_555 n
C22 H54 2.0601(35) 1_555 n
C22 H58 2.0629(31) 1_555 n
C23 C22 1.3867(31) 1_555 n
C23 C24 1.3849(31) 1_555 n
C23 H54 0.9800(8) 1_555 n
C23 H55 2.057(4) 1_555 n
C24 C23 1.3849(31) 1_555 n
C24 C25 1.3856(31) 1_555 n
C24 H54 2.0578(32) 1_555 n
C24 H55 0.9800(8) 1_555 n
C24 H56 2.058(4) 1_555 n
C25 C24 1.3856(31) 1_555 n
C25 C26 1.3827(32) 1_555 n
C25 H55 2.0584(32) 1_555 n
C25 H56 0.9800(8) 1_555 n
C25 H57 2.056(4) 1_555 n
C26 C25 1.3827(32) 1_555 n
C26 C27 1.3870(31) 1_555 n
C26 H56 2.0557(33) 1_555 n
C26 H57 0.9800(8) 1_555 n
C26 H58 2.059(4) 1_555 n
C27 C22 1.3897(31) 1_555 n
C27 C26 1.3870(31) 1_555 n
C27 H57 2.0605(32) 1_555 n
C27 H58 0.9800(8) 1_555 n
C28 P20 1.8147(32) 1_555 n
C28 C29 1.3887(31) 1_555 n
C28 C33 1.3899(31) 1_555 n
C28 H59 2.060(4) 1_555 n
C28 H63 2.0612(35) 1_555 n
C29 C28 1.3887(31) 1_555 n
C29 C30 1.3926(31) 1_555 n
C29 H59 0.9800(8) 1_555 n
C29 H60 2.0661(35) 1_555 n
C30 C29 1.3926(31) 1_555 n
C30 C31 1.3862(32) 1_555 n
C30 H59 2.0647(34) 1_555 n
C30 H60 0.9800(8) 1_555 n
C30 H61 2.059(4) 1_555 n
C31 C30 1.3862(32) 1_555 n
C31 C32 1.3839(32) 1_555 n
C31 H60 2.0581(34) 1_555 n
C31 H61 0.9800(8) 1_555 n
C31 H62 2.056(4) 1_555 n
C32 C31 1.3839(32) 1_555 n
C32 C33 1.3894(31) 1_555 n
C32 H61 2.0577(32) 1_555 n
C32 H62 0.9800(8) 1_555 n
C32 H63 2.061(4) 1_555 n
C33 C28 1.3899(31) 1_555 n
C33 C32 1.3894(31) 1_555 n
C33 H62 2.0620(33) 1_555 n
C33 H63 0.9800(8) 1_555 n
H34 C3 2.0587(32) 1_555 n
H34 C4 0.9800(8) 1_555 n
H34 C5 2.0613(34) 1_555 n
H35 C4 2.0626(34) 1_555 n
H35 C5 0.9800(8) 1_555 n
H35 C6 2.059(4) 1_555 n
H36 C5 2.0601(33) 1_555 n
H36 C6 0.9800(8) 1_555 n
H36 C7 2.060(4) 1_555 n
H37 C6 2.0573(33) 1_555 n
H37 C7 0.9800(8) 1_555 n
H37 C8 2.061(4) 1_555 n
H38 C3 2.0605(34) 1_555 n
H38 C7 2.0616(34) 1_555 n
H38 C8 0.9800(8) 1_555 n
H39 C9 2.0588(34) 1_555 n
H39 C10 0.9800(8) 1_555 n
H39 C11 2.0591(34) 1_555 n
H40 C10 2.0587(34) 1_555 n
H40 C11 0.9800(8) 1_555 n
H40 C12 2.059(4) 1_555 n
H41 C11 2.0588(34) 1_555 n
H41 C12 0.9800(8) 1_555 n
H41 C13 2.0564(34) 1_555 n
H42 C12 2.0569(35) 1_555 n
H42 C13 0.9800(8) 1_555 n
H42 C14 2.0610(34) 1_555 n
H43 C9 2.0591(34) 1_555 n
H43 C13 2.0610(34) 1_555 n
H43 C14 0.9800(8) 1_555 n
H44 P1 2.319(4) 1_555 n
H44 C15 0.9800(8) 1_555 n
H44 C16 2.0773(35) 1_555 n
H44 H45 1.5985(23) 1_555 n
H45 P1 2.319(7) 1_555 n
H45 C15 0.9800(8) 1_555 n
H45 C16 2.077(5) 1_555 n
H45 H44 1.5985(23) 1_555 n
H46 C15 2.079(4) 1_555 n
H46 C16 0.9800(8) 1_555 n
H46 C17 2.075(4) 1_555 n
H46 H47 1.6005(21) 1_555 n
H47 C15 2.078(8) 1_555 n
H47 C16 0.9800(8) 1_555 n
H47 C17 2.074(9) 1_555 n
H47 H46 1.6005(21) 1_555 n
H48 C16 2.075(6) 1_555 n
H48 C17 0.9800(8) 1_555 n
H48 C18 2.076(6) 1_555 n
H48 H49 1.6010(22) 1_555 n
H49 C16 2.076(4) 1_555 n
H49 C17 0.9800(8) 1_555 n
H49 C18 2.076(4) 1_555 n
H49 H48 1.6010(22) 1_555 n
H50 C17 2.074(6) 1_555 n
H50 C18 0.9800(8) 1_555 n
H50 C19 2.074(4) 1_555 n
H50 H51 1.5995(22) 1_555 n
H51 C17 2.074(5) 1_555 n
H51 C18 0.9800(8) 1_555 n
H51 C19 2.074(4) 1_555 n
H51 H50 1.5995(22) 1_555 n
H51 H51 1.945(34) -1_766 n
H52 C18 2.076(4) 1_555 n
H52 C19 0.9800(8) 1_555 n
H52 P20 2.316(4) 1_555 n
H52 H53 1.6013(30) 1_555 n
H53 C18 2.076(4) 1_555 n
H53 C19 0.9800(8) 1_555 n
H53 P20 2.316(5) 1_555 n
H53 H52 1.6013(30) 1_555 n
H53 H59 1.878(24) 1_555 n
H54 C22 2.0601(35) 1_555 n
H54 C23 0.9800(8) 1_555 n
H54 C24 2.0578(32) 1_555 n
H55 C23 2.057(4) 1_555 n
H55 C24 0.9800(8) 1_555 n
H55 C25 2.0584(32) 1_555 n
H56 C24 2.058(4) 1_555 n
H56 C25 0.9800(8) 1_555 n
H56 C26 2.0557(33) 1_555 n
H57 C25 2.056(4) 1_555 n
H57 C26 0.9800(8) 1_555 n
H57 C27 2.0605(32) 1_555 n
H58 C22 2.0629(31) 1_555 n
H58 C26 2.059(4) 1_555 n
H58 C27 0.9800(8) 1_555 n
H59 C28 2.060(4) 1_555 n
H59 C29 0.9800(8) 1_555 n
H59 C30 2.0647(34) 1_555 n
H59 H53 1.878(24) 1_555 n
H60 C29 2.0661(35) 1_555 n
H60 C30 0.9800(8) 1_555 n
H60 C31 2.0581(34) 1_555 n
H61 C30 2.059(4) 1_555 n
H61 C31 0.9800(8) 1_555 n
H61 C32 2.0577(32) 1_555 n
H62 C31 2.056(4) 1_555 n
H62 C32 0.9800(8) 1_555 n
H62 C33 2.0620(33) 1_555 n
H63 C28 2.0612(35) 1_555 n
H63 C32 2.061(4) 1_555 n
H63 C33 0.9800(8) 1_555 n
loop_
_pd_meas_counts_total
_pd_proc_ls_weight
_pd_proc_intensity_bkg_calc
_pd_calc_intensity_total
2310.0 0.000433 2344.71997 2344.72510
2321.0 0.000431 2346.35254 2346.35767
2335.0 0.000428 2347.98511 2347.99023
2315.0 0.000432 2349.61743 2349.62256
2325.0 0.000430 2351.25000 2351.25513
2315.0 0.000432 2352.88257 2352.88770
2336.0 0.000428 2354.51514 2354.52002
2339.0 0.000428 2356.14746 2356.15259
2310.0 0.000433 2357.78003 2357.78516
2339.0 0.000428 2359.41260 2359.41772
2342.0 0.000427 2361.04517 2361.05005
2327.0 0.000430 2362.67773 2362.68262
2364.0 0.000423 2364.31006 2364.31519
2364.0 0.000423 2365.94263 2365.94751
2349.0 0.000426 2367.57520 2367.58008
2370.0 0.000422 2369.20752 2369.21265
2356.0 0.000424 2370.84009 2371.41943
2391.0 0.000418 2372.47266 2373.10181
2360.0 0.000424 2374.10522 2374.79053
2384.0 0.000419 2375.73779 2376.48828
2405.0 0.000416 2377.37036 2378.19556
2372.0 0.000422 2379.00269 2379.91504
2362.0 0.000423 2380.63525 2381.65015
2392.0 0.000418 2382.26782 2383.40405
2376.0 0.000421 2383.90039 2385.18188
2374.0 0.000421 2385.53296 2386.99146
2373.0 0.000421 2387.16528 2388.84277
2390.0 0.000418 2388.79785 2390.75073
2417.0 0.000414 2390.43042 2392.73828
2408.0 0.000415 2392.06274 2394.84253
2428.0 0.000412 2393.69531 2397.12646
2394.0 0.000418 2395.32788 2399.71533
2407.0 0.000415 2396.96045 2402.94556
2426.0 0.000412 2398.59302 2407.85815
2446.0 0.000409 2400.22559 2416.83667
2452.0 0.000408 2401.85791 2431.86133
2458.0 0.000407 2403.49048 2449.90674
2461.0 0.000406 2405.12305 2461.18506
2455.0 0.000407 2406.75562 2468.93896
2486.0 0.000402 2408.38818 2478.44360
2517.0 0.000397 2410.02051 2486.26147
2574.0 0.000389 2411.65308 2498.00732
2607.0 0.000384 2413.28564 2513.34448
2681.0 0.000373 2414.91797 2533.57129
2653.0 0.000377 2416.55054 2551.50049
2636.0 0.000379 2418.18311 2538.74292
2559.0 0.000391 2419.81567 2490.06201
2490.0 0.000402 2421.44824 2454.92896
2474.0 0.000404 2423.08057 2441.04932
2448.0 0.000408 2424.71313 2436.89966
2444.0 0.000409 2426.34570 2435.90137
2462.0 0.000406 2427.97827 2436.11816
2452.0 0.000408 2429.61084 2437.00317
2423.0 0.000413 2431.24316 2438.34375
2453.0 0.000408 2432.87573 2440.05249
2416.0 0.000414 2434.50830 2442.12256
2433.0 0.000411 2436.14087 2444.61890
2438.0 0.000410 2437.77319 2447.72046
2466.0 0.000406 2439.40576 2451.92017
2462.0 0.000406 2441.03833 2458.77979
2493.0 0.000401 2442.67090 2472.26245
2520.0 0.000397 2444.30347 2497.52051
2477.0 0.000404 2445.93579 2531.91284
2555.0 0.000391 2447.56836 2561.54272
2518.0 0.000397 2449.20093 2573.81543
2560.0 0.000391 2450.83350 2592.70630
2592.0 0.000386 2452.46582 2610.41675
2635.0 0.000380 2454.09839 2633.42212
2681.0 0.000373 2455.73096 2666.14258
2707.0 0.000369 2457.36353 2705.74023
2715.0 0.000368 2458.99609 2718.60229
2636.0 0.000379 2460.62842 2648.49634
2543.0 0.000393 2462.26099 2555.96045
2549.0 0.000392 2463.89355 2507.69287
2492.0 0.000401 2465.52612 2490.03687
2501.0 0.000400 2467.15869 2483.60986
2475.0 0.000404 2468.79102 2480.83887
2454.0 0.000407 2470.42358 2479.66797
2450.0 0.000408 2472.05615 2479.38843
2473.0 0.000404 2473.68872 2479.65552
2472.0 0.000405 2475.32104 2480.27710
2480.0 0.000403 2476.95361 2481.13916
2447.0 0.000409 2478.55640 2482.14063
2488.0 0.000402 2480.14160 2483.24707
2490.0 0.000402 2481.72681 2484.44482
2477.0 0.000404 2483.31201 2485.71143
2477.0 0.000404 2484.89722 2487.03174
2480.0 0.000403 2486.48242 2488.39429
2486.0 0.000402 2488.06763 2489.79004
2440.0 0.000410 2489.65283 2491.21289
2492.0 0.000401 2491.23804 2491.24121
2495.0 0.000401 2492.82324 2492.82642
2500.0 0.000400 2494.40845 2494.41138
2499.0 0.000400 2495.99365 2495.99658
2505.0 0.000399 2497.57886 2497.58154
2499.0 0.000400 2499.16406 2499.16675
2477.0 0.000404 2500.74927 2500.75171
2503.0 0.000400 2502.33447 2502.33691
2505.0 0.000399 2503.91968 2503.92188
2467.0 0.000405 2505.50488 2505.50708
2493.0 0.000401 2507.09009 2507.09204
2498.0 0.000400 2508.67529 2509.97363
2502.0 0.000400 2510.26050 2511.66504
2456.0 0.000407 2511.84570 2513.37036
2501.0 0.000400 2513.43091 2515.09180
2510.0 0.000398 2515.01611 2516.83301
2528.0 0.000396 2516.60132 2518.59741
2518.0 0.000397 2518.18652 2520.39014
2534.0 0.000395 2519.77173 2522.21777
2510.0 0.000398 2521.35693 2524.08813
2503.0 0.000400 2522.94214 2526.01343
2548.0 0.000392 2524.52734 2528.00757
2515.0 0.000398 2526.11255 2530.09229
2536.0 0.000394 2527.69751 2532.29639
2553.0 0.000392 2529.28296 2534.66382
2536.0 0.000394 2530.86792 2537.25928
2542.0 0.000393 2532.45313 2540.18701
2541.0 0.000394 2534.03857 2543.62158
2563.0 0.000390 2535.62354 2547.90381
2546.0 0.000393 2537.20874 2553.88550
2584.0 0.000387 2538.79419 2563.94287
2571.0 0.000389 2540.37915 2583.31958
2587.0 0.000387 2541.96436 2617.59790
2612.0 0.000383 2543.54956 2662.65479
2664.0 0.000375 2545.13477 2701.30127
2696.0 0.000371 2546.71997 2723.60522
2722.0 0.000367 2548.30518 2754.00903
2819.0 0.000355 2549.89038 2787.08838
2876.0 0.0003477 2551.47559 2830.85400
2942.0 0.0003399 2553.06079 2865.47266
2880.0 0.0003472 2554.64600 2834.62598
2771.0 0.000361 2556.23120 2727.04810
2666.0 0.000375 2557.81641 2642.43262
2596.0 0.000385 2559.40161 2603.25073
2563.0 0.000390 2560.98682 2588.05103
2581.0 0.000387 2562.57202 2581.59351
2572.0 0.000389 2564.15723 2578.41577
2549.0 0.000392 2565.74243 2576.85522
2577.0 0.000388 2567.32764 2576.24219
2577.0 0.000388 2568.91284 2576.22925
2562.0 0.000390 2570.49805 2576.61475
2588.0 0.000386 2572.08325 2577.27588
2571.0 0.000389 2573.66846 2578.13330
2572.0 0.000389 2575.25366 2579.13501
2575.0 0.000388 2576.83887 2580.24463
2560.0 0.000391 2578.42407 2581.43750
2561.0 0.000390 2580.00928 2582.69482
2578.0 0.000388 2581.59448 2584.00317
2584.0 0.000387 2583.17969 2585.35254
2554.0 0.000392 2584.76489 2584.76147
2573.0 0.000389 2586.35010 2586.34668
2568.0 0.000389 2587.93530 2587.93164
2580.0 0.000388 2589.52051 2589.51685
2601.0 0.000384 2591.10571 2591.10181
2595.0 0.000385 2592.69092 2592.68701
2576.0 0.000388 2594.27612 2594.27197
2548.0 0.000392 2595.86133 2595.85718
2590.0 0.000386 2597.44653 2597.44214
2563.0 0.000390 2599.03174 2599.02734
2584.0 0.000387 2600.61694 2600.61230
2582.0 0.000387 2602.20215 2602.19751
2588.0 0.000386 2603.78735 2603.78247
2608.0 0.000383 2605.37256 2605.36768
2608.0 0.000383 2606.24634 2606.24146
2603.0 0.000384 2605.06519 2605.06055
2602.0 0.000384 2603.88403 2603.87964
2618.0 0.000382 2602.70288 2602.69849
2616.0 0.000382 2601.52173 2601.51758
2598.0 0.000385 2600.34082 2600.33667
2590.0 0.000386 2599.15967 2599.15552
2596.0 0.000385 2597.97852 2597.97461
2570.0 0.000389 2596.79736 2596.79370
2578.0 0.000388 2595.61621 2595.61255
2604.0 0.000384 2594.43506 2594.43164
2572.0 0.000389 2593.25391 2593.25073
2611.0 0.000383 2592.07275 2592.06958
2581.0 0.000387 2590.89160 2590.88867
2600.0 0.000385 2589.71069 2589.70776
2601.0 0.000384 2588.52954 2588.52661
2578.0 0.000388 2587.34839 2587.34570
2570.0 0.000389 2586.16724 2586.16479
2576.0 0.000388 2584.98608 2584.98364
2602.0 0.000384 2583.80493 2583.80273
2603.0 0.000384 2582.62378 2582.62183
2581.0 0.000387 2581.44263 2581.44067
2598.0 0.000385 2580.26147 2580.25977
2598.0 0.000385 2579.08032 2579.07886
2590.0 0.000386 2577.89917 2577.89771
2602.0 0.000384 2576.71802 2576.71680
2585.0 0.000387 2575.53687 2575.53589
2597.0 0.000385 2574.35596 2574.35498
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2550.0 0.000392 2202.84814 2450.88330
2501.0 0.000400 2199.64478 2372.47168
2428.0 0.000412 2196.44141 2324.72632
2415.0 0.000414 2193.23853 2296.39819
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2368.0 0.000422 2186.83154 2262.39844
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2202.0 0.000454 2170.81470 2260.19775
2225.0 0.000449 2167.61133 2256.70483
2225.0 0.000449 2164.40820 2254.18237
2197.0 0.000455 2161.20435 2224.43872
2225.0 0.000449 2158.00146 2225.71045
2199.0 0.000455 2154.79858 2227.79492
2210.0 0.000452 2151.59424 2230.80298
2211.0 0.000452 2148.39136 2231.52075
2230.0 0.000448 2145.18823 2237.18799
2227.0 0.000449 2141.98438 2244.35474
2248.0 0.000445 2138.78101 2257.65186
2258.0 0.000443 2135.57861 2276.73877
2273.0 0.000440 2132.37427 2291.92163
2281.0 0.000438 2129.17114 2310.98242
2278.0 0.000439 2125.96826 2335.09985
2342.0 0.000427 2122.76489 2366.44238
2385.0 0.000419 2119.56104 2406.43286
2483.0 0.000403 2116.35791 2459.20996
2544.0 0.000393 2113.15527 2530.84619
2720.0 0.000368 2109.95117 2632.57715
2896.0 0.0003453 2106.74780 2786.48218
3204.0 0.0003121 2103.54492 3035.73462
3708.0 0.0002697 2098.90698 3454.63159
4421.0 0.0002262 2094.13550 4162.90332
5426.0 0.0001843 2089.36499 5244.13867
6754.0 0.0001481 2084.59204 6640.68701
8117.0 0.0001232 2079.82031 8035.22754
8898.0 0.0001124 2075.04883 8805.25000
8490.0 0.0001178 2070.27686 8229.60156
6997.0 0.0001429 2065.50537 6710.95117
5509.0 0.0001815 2060.73462 5223.37500
4444.0 0.0002250 2055.96167 4167.48096
3810.0 0.0002625 2051.19019 3537.43872
3411.0 0.0002932 2046.41858 3219.42554
3243.0 0.0003084 2041.64661 3114.84888
3194.0 0.0003131 2036.87512 3172.58228
3266.0 0.0003062 2032.10449 3370.54639
3444.0 0.0002904 2027.33154 3670.33569
3732.0 0.0002680 2022.55994 3971.09473
3860.0 0.0002591 2017.78845 4115.44434
3684.0 0.0002714 2013.01685 3960.53711
3272.0 0.0003056 2008.24487 3575.67505
2932.0 0.0003411 2003.47327 3190.18457
2721.0 0.000368 1998.70276 2913.59277
2621.0 0.000382 1993.92981 2753.97754
2606.0 0.000384 1989.15820 2704.34741
2655.0 0.000377 1984.38672 2766.71387
2811.0 0.000356 1979.61462 2960.16357
3193.0 0.0003132 1974.84314 3307.40063
3658.0 0.0002734 1970.07251 3786.20288
4138.0 0.0002417 1965.29956 4286.59814
4469.0 0.0002238 1960.52795 4582.85498
4222.0 0.0002369 1955.75647 4450.62988
3596.0 0.0002781 1950.98450 3984.16992
2988.0 0.0003347 1946.21289 3427.02393
2599.0 0.000385 1941.44177 2918.82568
2375.0 0.000421 1936.66931 2595.96631
2251.0 0.000444 1931.89783 2390.03271
2170.0 0.000461 1927.12622 2261.37598
2155.0 0.000464 1922.35425 2178.86719
2102.0 0.000476 1917.58264 2122.92334
2100.0 0.000476 1912.81165 2082.89844
2066.0 0.000484 1908.03906 2052.07104
2037.0 0.000491 1903.26758 2027.65906
2043.0 0.000489 1898.49609 2007.85559
2021.0 0.000495 1893.72449 1991.56250
2010.0 0.000498 1888.95251 1973.69666
2026.0 0.000494 1884.18091 1954.78723
2007.0 0.000498 1879.40991 1945.42627
1973.0 0.000507 1874.63733 1936.81921
1971.0 0.000507 1869.86584 1928.70178
2001.0 0.000500 1865.09424 1922.59985
1996.0 0.000501 1860.32227 1918.29309
1988.0 0.000503 1855.55078 1916.20337
1974.0 0.000507 1850.77966 1917.21472
2016.0 0.000496 1846.00720 1923.09753
2015.0 0.000496 1841.23560 1936.92651
2058.0 0.000486 1836.46411 1990.66345
2100.0 0.000476 1831.69202 2036.16162
2153.0 0.000464 1826.92053 2090.12939
2186.0 0.000457 1822.14941 2157.71558
2159.0 0.000463 1817.37695 2222.88354
2154.0 0.000464 1812.60547 2248.48242
2115.0 0.000473 1807.83386 2227.51953
2063.0 0.000485 1803.06189 2164.98438
2040.0 0.000490 1798.29028 2086.97461
2031.0 0.000492 1793.51929 2026.39709
2044.0 0.000489 1788.74670 1993.04468
2047.0 0.000489 1783.97522 1980.49841
2036.0 0.000491 1779.20361 1976.33630
2064.0 0.000484 1774.43213 1968.01819
2050.0 0.000488 1769.66003 1955.50439
1995.0 0.000501 1764.88855 1947.92542
1985.0 0.000504 1760.11743 1950.35681
1997.0 0.000501 1755.34497 1964.27783
1988.0 0.000503 1750.57349 1990.92212
2030.0 0.000493 1745.80188 2033.59973
2064.0 0.000484 1741.02991 2117.91089
2175.0 0.000460 1736.25830 2228.42700
2320.0 0.000431 1731.48730 2416.39160
2608.0 0.000383 1726.71472 2740.00000
3082.0 0.0003245 1721.94324 3271.87378
3908.0 0.0002559 1717.17175 4051.51611
5016.0 0.0001994 1713.80469 4982.37012
6147.0 0.0001627 1711.62109 5766.64844
6478.0 0.0001544 1709.43787 5917.11523
5605.0 0.0001784 1707.25378 5220.97021
4187.0 0.0002388 1705.07043 4205.07764
3217.0 0.0003108 1702.88696 3352.18481
2589.0 0.000386 1700.70300 2776.57739
2344.0 0.000427 1698.51978 2433.45410
2172.0 0.000460 1696.33643 2239.67798
2125.0 0.000471 1694.15234 2130.11182
2067.0 0.000484 1691.96887 2066.38306
2040.0 0.000490 1689.78552 2030.06653
2046.0 0.000489 1687.60205 2013.73572
2089.0 0.000479 1685.41809 2015.82532
2160.0 0.000463 1683.23486 2039.45361
2233.0 0.000448 1681.05151 2100.83203
2349.0 0.000426 1678.86743 2213.56982
2561.0 0.000390 1676.68396 2419.09937
2854.0 0.0003504 1674.50061 2762.03613
3275.0 0.0003053 1672.31677 3260.03613
3790.0 0.0002639 1670.13318 3836.61719
4195.0 0.0002384 1667.95020 4297.11475
4366.0 0.0002290 1665.76599 4314.05615
4005.0 0.0002497 1663.58252 3827.24902
3295.0 0.0003035 1661.39905 3191.81641
2706.0 0.000370 1659.21533 2676.41162
2390.0 0.000418 1657.03186 2334.16699
2215.0 0.000451 1654.84875 2130.22827
2119.0 0.000472 1652.66455 2014.49573
2074.0 0.000482 1650.48108 1948.78113
2106.0 0.000475 1648.29761 1885.89661
2078.0 0.000481 1646.11389 1870.68591
2067.0 0.000484 1643.93042 1874.93091
2008.0 0.000498 1641.74731 1902.45154
1958.0 0.000511 1639.56323 1955.88257
1905.0 0.000525 1637.37976 2026.12463
1906.0 0.000525 1635.19617 2089.80054
1910.0 0.000524 1633.01270 2110.02930
1933.0 0.000517 1630.82898 2088.74121
1929.0 0.000518 1628.64551 2091.30322
2013.0 0.000497 1626.46240 2164.85522
2091.0 0.000478 1624.27832 2321.28687
2203.0 0.000454 1622.09485 2531.13062
2384.0 0.000419 1619.91138 2724.68848
2461.0 0.000406 1617.72766 2811.14844
2685.0 0.000372 1615.54407 2813.71362
2957.0 0.0003382 1613.36108 2874.87842
3298.0 0.0003032 1611.17688 3038.46362
3669.0 0.0002726 1608.99341 3208.86938
3578.0 0.0002795 1606.80994 3188.32568
3168.0 0.0003157 1604.62622 2924.19287
2660.0 0.000376 1602.44275 2557.85938
2305.0 0.000434 1600.25940 2248.90308
2076.0 0.000482 1598.07544 2035.97766
1985.0 0.000504 1595.89197 1905.48438
1932.0 0.000518 1593.70850 1830.14478
1870.0 0.000535 1591.52478 1787.82507
1830.0 0.000546 1589.34131 1766.00952
1795.0 0.000557 1587.15808 1760.07434
1791.0 0.000558 1584.97412 1770.70508
1772.0 0.000564 1582.79065 1801.70129
1818.0 0.000550 1580.60706 1857.18530
1838.0 0.000544 1578.42358 1935.00610
1858.0 0.000538 1576.23987 2026.36951
1863.0 0.000537 1574.05640 2076.63354
1895.0 0.000528 1571.87317 2077.27808
1878.0 0.000532 1569.68921 2008.82898
1847.0 0.000541 1567.50574 1905.41492
1775.0 0.000563 1565.32227 1809.99536
1756.0 0.000569 1563.13855 1739.64417
1731.0 0.000578 1560.95496 1693.76172
1718.0 0.000582 1558.77173 1665.57678
1749.0 0.000572 1556.58777 1649.35608
1717.0 0.000582 1554.40430 1641.29700
1751.0 0.000571 1552.22083 1640.07288
1755.0 0.000570 1550.03711 1646.46130
1780.0 0.000562 1547.85364 1662.47424
1828.0 0.000547 1545.67029 1681.50757
1869.0 0.000535 1543.48633 1717.30786
1910.0 0.000524 1541.30286 1750.43567
1955.0 0.000512 1539.11938 1763.32385
1860.0 0.000538 1537.16113 1746.75281
1802.0 0.000555 1536.29285 1719.19250
1753.0 0.000570 1535.42456 1701.41833
1715.0 0.000583 1534.55603 1704.31995
1747.0 0.000572 1533.68774 1735.31775
1828.0 0.000547 1532.81946 1804.03552
1946.0 0.000514 1531.95105 1921.70569
2148.0 0.000466 1531.08264 2091.00464
2516.0 0.000397 1530.21436 2285.34253
2726.0 0.000367 1529.34607 2435.51709
2733.0 0.000366 1528.47754 2445.70117
2450.0 0.000408 1527.60925 2294.82910
2127.0 0.000470 1526.74084 2089.25464
1902.0 0.000526 1525.87244 1917.03601
1802.0 0.000555 1525.00415 1798.69958
1748.0 0.000572 1524.13586 1729.16382
1737.0 0.000576 1523.26733 1693.17493
1694.0 0.000590 1522.39905 1675.72681
1660.0 0.000602 1521.53076 1661.39307
1675.0 0.000597 1520.66223 1650.49475
1659.0 0.000603 1519.79395 1650.01794
1677.0 0.000596 1518.92566 1665.18848
1727.0 0.000579 1518.05713 1695.69653
1783.0 0.000561 1517.18884 1732.36255
1839.0 0.000544 1516.32056 1755.87183
1767.0 0.000566 1515.45203 1744.27759
1703.0 0.000587 1514.58374 1701.35010
1635.0 0.000612 1513.71545 1652.36584
1587.0 0.000630 1512.84692 1618.44348
1568.0 0.000638 1511.97864 1592.72864
1523.0 0.000657 1511.11035 1576.17651
1493.0 0.000670 1510.24194 1565.88416
1495.0 0.000669 1509.37354 1559.07874
1491.0 0.000671 1508.50525 1553.98572
1479.0 0.000676 1507.63696 1550.45239
1498.0 0.000668 1506.76843 1548.76941
1478.0 0.000677 1505.90015 1548.89954
1476.0 0.000678 1505.03186 1545.49536
1474.0 0.000678 1504.16333 1552.09705
1531.0 0.000653 1503.29492 1564.34509
1492.0 0.000670 1502.42676 1586.14136
1520.0 0.000658 1501.55823 1623.36829
1513.0 0.000661 1500.68982 1679.84656
1487.0 0.000672 1499.82166 1750.91980
1505.0 0.000664 1498.95313 1817.61658
1477.0 0.000677 1498.08472 1840.38940
1494.0 0.000669 1497.21655 1800.03003
1497.0 0.000668 1496.34802 1728.95056
1467.0 0.000682 1495.47974 1668.15161
1469.0 0.000681 1494.61133 1632.04053
1494.0 0.000669 1493.74292 1621.40015
1517.0 0.000659 1492.87463 1635.21521
1540.0 0.000649 1492.00647 1674.38806
1576.0 0.000635 1491.13782 1745.46887
1707.0 0.000586 1490.26953 1846.43018
1841.0 0.000543 1489.40112 1958.61047
1913.0 0.000523 1488.53284 2037.44250
1906.0 0.000525 1487.66443 2027.67700
1809.0 0.000553 1486.79602 1929.24768
1698.0 0.000589 1485.92786 1806.87976
1594.0 0.000627 1485.05933 1706.05554
1541.0 0.000649 1484.19092 1637.00049
1549.0 0.000646 1483.32263 1594.68640
1536.0 0.000651 1482.45422 1570.87756
1542.0 0.000649 1481.58594 1558.92981
1561.0 0.000641 1480.71777 1555.25037
1615.0 0.000619 1479.84912 1559.02173
1682.0 0.000595 1478.98083 1571.29993
1818.0 0.000550 1478.11243 1593.84497
1932.0 0.000518 1477.24402 1627.22131
2016.0 0.000496 1476.37573 1668.12073
2090.0 0.000478 1475.50757 1702.34338
2016.0 0.000496 1474.63892 1721.91284
1963.0 0.000509 1473.77063 1696.42346
1842.0 0.000543 1472.90222 1653.73022
1744.0 0.000573 1472.03381 1613.10413
1682.0 0.000595 1471.16553 1584.33057
1643.0 0.000609 1470.29724 1568.95520
1632.0 0.000613 1469.42871 1564.82483
1632.0 0.000613 1468.56042 1567.11328
1638.0 0.000611 1467.69202 1568.63428
1642.0 0.000609 1466.82373 1562.49988
1624.0 0.000616 1464.97046 1548.69324
1617.0 0.000618 1462.87122 1534.75085
1640.0 0.000610 1460.77209 1520.68420
1677.0 0.000596 1458.67236 1515.24414
1698.0 0.000589 1456.57300 1513.48999
1694.0 0.000590 1454.47363 1514.68616
1640.0 0.000610 1452.37415 1518.46619
1594.0 0.000627 1450.27478 1524.95764
1529.0 0.000654 1448.17578 1536.88000
1542.0 0.000649 1446.07605 1552.71899
1532.0 0.000653 1443.97668 1575.29858
1578.0 0.000634 1441.87732 1610.79517
1642.0 0.000609 1439.77783 1668.41565
1740.0 0.000575 1437.67847 1762.13342
1872.0 0.000534 1435.57935 1908.67993
2090.0 0.000478 1433.47961 2119.50610
2380.0 0.000420 1431.38037 2383.52612
2630.0 0.000380 1429.28101 2644.49561
2834.0 0.000353 1427.18152 2796.78125
2798.0 0.000357 1425.08215 2738.55688
2553.0 0.000392 1422.98303 2488.71191
2219.0 0.000451 1420.88330 2192.55566
1940.0 0.000515 1418.78406 1948.23083
1770.0 0.000565 1416.68469 1777.64624
1636.0 0.000611 1414.58545 1668.39905
1590.0 0.000629 1412.48584 1601.92456
1519.0 0.000658 1410.38660 1561.43677
1487.0 0.000672 1408.28748 1536.90698
1446.0 0.000692 1406.18774 1522.37927
1429.0 0.000700 1404.08838 1515.92883
1416.0 0.000706 1401.98901 1518.22388
1447.0 0.000691 1399.88953 1532.08936
1465.0 0.000683 1397.79028 1561.84888
1511.0 0.000662 1395.69116 1611.34888
1586.0 0.000631 1393.59143 1679.20471
1694.0 0.000590 1391.49207 1750.78259
1736.0 0.000576 1389.39270 1794.35388
1738.0 0.000575 1387.29321 1776.42322
1606.0 0.000623 1385.19385 1703.81982
1497.0 0.000668 1383.09485 1618.29089
1438.0 0.000695 1380.99500 1547.10620
1395.0 0.000717 1378.89575 1496.42896
1385.0 0.000722 1376.79639 1463.25806
1370.0 0.000730 1374.69690 1442.50012
1355.0 0.000738 1372.59753 1428.87378
1356.0 0.000737 1370.49841 1421.60303
1366.0 0.000732 1368.39856 1408.38818
1403.0 0.000713 1366.29944 1410.09766
1447.0 0.000691 1364.20007 1415.47302
1502.0 0.000666 1362.10083 1422.98279
1571.0 0.000637 1360.00122 1428.73096
1560.0 0.000641 1357.90198 1427.22046
1518.0 0.000659 1355.80286 1416.40125
1470.0 0.000680 1353.70288 1401.06372
1456.0 0.000687 1351.60376 1386.59106
1412.0 0.000708 1349.50439 1375.01746
1405.0 0.000712 1347.40466 1366.34497
1423.0 0.000703 1345.30566 1359.90686
1447.0 0.000691 1343.20654 1354.95801
1497.0 0.000668 1341.10657 1352.48071
1573.0 0.000636 1339.00720 1349.29126
1624.0 0.000616 1336.90808 1346.23877
1659.0 0.000603 1334.80835 1343.41504
1606.0 0.000623 1332.70911 1340.75928
1520.0 0.000658 1330.61023 1335.17871
1428.0 0.000700 1328.51025 1332.96484
1387.0 0.000721 1326.41089 1330.82056
1336.0 0.000749 1324.31165 1328.80627
1302.0 0.000768 1322.21204 1326.78247
1294.0 0.000773 1320.11279 1324.81262
1268.0 0.000789 1318.01379 1322.89722
1285.0 0.000778 1315.91394 1321.03735
1277.0 0.000783 1313.81458 1319.37537
1288.0 0.000776 1311.71533 1317.65759
1252.0 0.000799 1309.61597 1316.02148
1268.0 0.000789 1307.51648 1316.56335
1262.0 0.000792 1305.41711 1315.29712
1297.0 0.000771 1303.31824 1314.19836
1298.0 0.000770 1301.21826 1313.31592
1287.0 0.000777 1299.11890 1312.23340
1289.0 0.000776 1297.01965 1312.11414
1279.0 0.000782 1294.39709 1312.13342
1288.0 0.000776 1291.07739 1312.48108
1314.0 0.000761 1287.75854 1314.33496
1334.0 0.000750 1284.43787 1318.18420
1369.0 0.000730 1281.11829 1324.20166
1412.0 0.000708 1277.79871 1332.11768
1444.0 0.000693 1274.47876 1339.20691
1486.0 0.000673 1271.15918 1343.93188
1452.0 0.000689 1267.84021 1349.36548
1422.0 0.000703 1264.51965 1358.17932
1401.0 0.000714 1261.19995 1377.67603
1407.0 0.000711 1257.88037 1411.69971
1418.0 0.000705 1254.56042 1460.58752
1491.0 0.000671 1251.24084 1517.17224
1518.0 0.000659 1247.92151 1565.04504
1522.0 0.000657 1244.60132 1576.13647
1514.0 0.000661 1241.28174 1548.25854
1468.0 0.000681 1237.96204 1508.12219
1425.0 0.000702 1234.64246 1483.31836
1425.0 0.000702 1231.32251 1485.35217
1429.0 0.000700 1228.00293 1513.74500
1440.0 0.000694 1224.68372 1554.13062
1496.0 0.000668 1221.36340 1579.78101
1544.0 0.000648 1218.04382 1559.82837
1599.0 0.000625 1214.72412 1495.94470
1573.0 0.000636 1211.40430 1423.21680
1514.0 0.000661 1208.08459 1365.48047
1469.0 0.000681 1204.76538 1327.33215
1409.0 0.000710 1201.44507 1307.41577
1360.0 0.000735 1198.12549 1302.58081
1378.0 0.000726 1194.80591 1310.72437
1390.0 0.000719 1191.48596 1330.75159
1483.0 0.000674 1188.16638 1360.62622
1518.0 0.000659 1184.84705 1395.42456
1524.0 0.000656 1181.52673 1427.72998
1513.0 0.000661 1178.20715 1448.68848
1465.0 0.000683 1174.88757 1448.37061
1416.0 0.000706 1171.56763 1430.00684
1332.0 0.000751 1168.24805 1416.25513
1303.0 0.000767 1164.92871 1425.63989
1282.0 0.000780 1161.60852 1459.81677
1289.0 0.000776 1158.28894 1501.64978
1294.0 0.000773 1154.96924 1518.46436
1278.0 0.000782 1151.64966 1486.25500
1215.0 0.000823 1148.32971 1423.18408
1192.0 0.000839 1145.01013 1363.89697
1175.0 0.000851 1141.69080 1324.14709
1174.0 0.000852 1138.37061 1302.68262
1163.0 0.000860 1135.05103 1289.77307
1132.0 0.000883 1131.73132 1275.14612
1143.0 0.000875 1128.41138 1257.21277
1153.0 0.000867 1125.09180 1241.95715
1143.0 0.000875 1121.77258 1229.82190
1161.0 0.000861 1118.45227 1226.88745
1170.0 0.000855 1115.13269 1224.11499
1176.0 0.000850 1111.81311 1216.78625
1166.0 0.000858 1108.49316 1206.90308
1182.0 0.000846 1105.17346 1200.08154
1185.0 0.000844 1101.85425 1198.05920
1187.0 0.000842 1098.53394 1197.24573
1203.0 0.000831 1095.21436 1191.07153
1211.0 0.000826 1091.89478 1180.02295
1205.0 0.000830 1088.57483 1160.39038
1169.0 0.000855 1085.25525 1139.94287
1166.0 0.000858 1081.93591 1124.89282
1172.0 0.000853 1078.61572 1113.11975
1137.0 0.000880 1075.29602 1104.39795
1119.0 0.000894 1071.97644 1097.99036
1131.0 0.000884 1068.65686 1093.30859
1105.0 0.000905 1065.33691 1089.98682
1087.0 0.000920 1062.01733 1085.65857
1089.0 0.000918 1058.69800 1084.50610
1090.0 0.000917 1055.37781 1083.65710
1085.0 0.000922 1052.05811 1082.17688
1084.0 0.000923 1048.73853 1079.36194
1105.0 0.000905 1045.41833 1075.69153
1086.0 0.000921 1042.09900 1071.50500
1087.0 0.000920 1038.77979 1069.23401
1099.0 0.000910 1035.45911 1068.34802
1122.0 0.000891 1032.13989 1069.09277
1093.0 0.000915 1028.82031 1071.86963
1101.0 0.000908 1025.70605 1077.75818
1126.0 0.000888 1025.98804 1091.81653
1146.0 0.000873 1026.26978 1114.30786
1163.0 0.000860 1026.55188 1151.46338
1190.0 0.000840 1026.83374 1211.79480
1270.0 0.000787 1027.11560 1303.45276
1327.0 0.000754 1027.39758 1427.18323
1411.0 0.000709 1027.67944 1563.39429
1465.0 0.000683 1027.96130 1661.77075
1493.0 0.000670 1028.24329 1663.19556
1421.0 0.000704 1028.52527 1564.52551
1337.0 0.000748 1028.80713 1429.89075
1258.0 0.000795 1029.08899 1308.60474
1186.0 0.000843 1029.37097 1218.07874
1141.0 0.000876 1029.65295 1157.96301
1108.0 0.000903 1029.93481 1120.97668
1100.0 0.000909 1030.21680 1097.61914
1081.0 0.000925 1030.49866 1083.41614
1100.0 0.000909 1030.78052 1074.13257
1093.0 0.000915 1031.06250 1067.62390
1062.0 0.000942 1031.34436 1062.93604
1076.0 0.000929 1031.62622 1059.50647
1080.0 0.000926 1031.90820 1057.11511
1096.0 0.000912 1032.19019 1055.36072
1104.0 0.000906 1032.47205 1054.22058
1102.0 0.000907 1032.75403 1053.62927
1134.0 0.000882 1033.03589 1053.57153
1148.0 0.000871 1033.31775 1054.09082
1156.0 0.000865 1033.59973 1056.57629
1168.0 0.000856 1033.88171 1058.86438
1176.0 0.000850 1034.16357 1063.94592
1174.0 0.000852 1034.44556 1070.69348
1189.0 0.000841 1034.72742 1081.37305
1235.0 0.000810 1035.00928 1097.59009
1274.0 0.000785 1035.29126 1120.11255
1306.0 0.000766 1035.57324 1147.18250
1290.0 0.000775 1035.85510 1167.52417
1301.0 0.000769 1036.13696 1179.53369
1302.0 0.000768 1036.41895 1171.55920
1266.0 0.000790 1036.70081 1152.51587
1230.0 0.000813 1036.98267 1134.55798
1221.0 0.000819 1037.26465 1123.26880
1252.0 0.000799 1037.54663 1117.64648
1227.0 0.000815 1037.82849 1113.41138
1220.0 0.000820 1038.11047 1107.50854
1166.0 0.000858 1038.39233 1100.91516
1142.0 0.000876 1038.67419 1095.36987
1131.0 0.000884 1038.95618 1091.36951
1094.0 0.000914 1039.23816 1089.72217
1100.0 0.000909 1039.52002 1091.56323
1112.0 0.000899 1039.80200 1097.55957
1090.0 0.000917 1040.08386 1108.39856
1135.0 0.000881 1040.36572 1125.29248
1173.0 0.000853 1040.64771 1148.72595
1242.0 0.000805 1040.92957 1175.33704
1258.0 0.000795 1041.21155 1196.18689
1248.0 0.000801 1041.49341 1200.18518
1210.0 0.000826 1041.77539 1186.01990
1150.0 0.000870 1042.05725 1164.57666
1148.0 0.000871 1042.33923 1145.35303
1115.0 0.000897 1042.62109 1131.85840
1103.0 0.000907 1042.90308 1125.88904
1088.0 0.000919 1043.18494 1128.78149
1077.0 0.000929 1043.46692 1141.37183
1078.0 0.000928 1043.74878 1163.50134
1095.0 0.000913 1044.03064 1193.53833
1108.0 0.000903 1044.31262 1223.29321
1136.0 0.000880 1044.59448 1241.02075
1100.0 0.000909 1044.87646 1235.03796
1089.0 0.000918 1045.15845 1207.41296
1080.0 0.000926 1045.44031 1172.14392
1069.0 0.000935 1045.72217 1139.96423
1058.0 0.000945 1046.00415 1115.41589
1063.0 0.000941 1046.28601 1098.15430
1083.0 0.000923 1046.56799 1086.67773
1073.0 0.000932 1046.84985 1079.53088
1105.0 0.000905 1047.13184 1075.26733
1076.0 0.000929 1047.41370 1074.31726
1088.0 0.000919 1047.69568 1073.39807
1049.0 0.000953 1047.97754 1073.34985
1030.0 0.000971 1048.25952 1073.56519
1008.0 0.000992 1048.54138 1073.46277
1001.0 0.000999 1047.38879 1071.50647
972.0 0.001029 1045.57898 1069.11011
1009.0 0.000991 1043.76855 1067.21082
985.0 0.001015 1041.95850 1067.59192
982.0 0.001018 1040.14856 1067.80798
970.0 0.001031 1038.33850 1069.22595
999.0 0.001001 1036.52832 1071.79199
988.0 0.001012 1034.71826 1075.12170
999.0 0.001001 1032.90833 1079.43652
1009.0 0.000991 1031.09802 1082.46667
1016.0 0.000984 1029.28796 1085.14941
1018.0 0.000982 1027.47791 1089.94604
1051.0 0.000951 1025.66772 1099.10303
1079.0 0.000927 1023.85767 1114.79150
1115.0 0.000897 1022.04779 1138.68140
1184.0 0.000845 1020.23724 1173.65125
1228.0 0.000814 1018.42737 1219.66553
1323.0 0.000756 1016.61737 1275.60181
1455.0 0.000687 1014.80695 1337.16565
1534.0 0.000652 1012.99707 1391.13611
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471.0 0.002123 449.53809 475.00293
486.0 0.002058 449.35178 473.96829
453.0 0.002208 449.16547 472.69217
480.0 0.002083 448.97919 471.25815
473.0 0.002114 448.79288 469.81787
473.0 0.002114 448.60663 468.53848
467.0 0.002141 448.42023 467.51968
481.0 0.002079 448.23395 466.76547
466.0 0.002146 448.04764 466.15201
471.0 0.002123 447.86133 465.62378
471.0 0.002123 447.67505 465.15033
469.0 0.002132 447.48874 464.76526
458.0 0.002183 447.30240 464.48318
471.0 0.002123 447.11609 464.44995
473.0 0.002114 446.92981 464.55276
458.0 0.002183 446.74350 464.82306
467.0 0.002141 446.55719 465.17685
470.0 0.002128 446.37094 465.47580
483.0 0.002070 446.18457 465.56177
470.0 0.002128 445.99826 465.66565
483.0 0.002070 445.81195 465.75156
478.0 0.002092 445.62567 465.86465
474.0 0.002110 445.43936 466.02045
477.0 0.002096 445.25305 466.23880
480.0 0.002083 445.06677 466.52914
475.0 0.002105 444.88043 466.88333
485.0 0.002062 444.69412 467.21573
470.0 0.002128 444.50781 467.34409
460.0 0.002174 444.32153 467.30685
470.0 0.002128 444.13522 467.09436
454.0 0.002203 443.94897 466.83441
464.0 0.002155 443.76257 466.62558
470.0 0.002128 443.57629 466.46338
459.0 0.002179 443.38998 466.32993
456.0 0.002193 443.20367 466.14392
456.0 0.002193 443.01740 465.86536
447.0 0.002237 442.83109 465.44788
456.0 0.002193 442.64474 464.90839
462.0 0.002165 442.45844 464.32831
458.0 0.002183 442.27216 463.70822
445.0 0.002247 442.08585 463.42542
452.0 0.002212 441.89954 463.44135
450.0 0.002222 441.71329 463.80206
450.0 0.002222 441.52692 464.61609
453.0 0.002208 441.34061 465.70123
458.0 0.002183 441.15430 467.06647
463.0 0.002160 440.96802 468.63550
465.0 0.002151 440.78171 470.03534
464.0 0.002155 440.59540 470.88019
461.0 0.002169 440.40912 470.88464
458.0 0.002183 440.22278 469.99200
467.0 0.002141 440.03647 468.37372
460.0 0.002174 439.85019 466.26187
454.0 0.002203 439.66388 463.83682
450.0 0.002222 439.47757 461.24258
463.0 0.002160 439.29132 458.65897
453.0 0.002208 439.10495 456.40732
453.0 0.002208 438.91864 454.48779
458.0 0.002183 438.73233 453.04703
451.0 0.002217 438.54605 452.01907
452.0 0.002212 438.35974 451.46942
458.0 0.002183 438.17343 451.32913
464.0 0.002155 437.98709 451.59171
456.0 0.002193 437.77466 452.15909
454.0 0.002203 437.51801 452.93170
455.0 0.002198 437.26135 453.85553
459.0 0.002179 437.00470 454.81320
468.0 0.002137 436.74811 455.70444
454.0 0.002203 436.49133 456.47415
460.0 0.002174 436.23468 457.10403
458.0 0.002183 435.97803 457.49258
480.0 0.002083 435.72137 457.67557
473.0 0.002114 435.46472 457.47104
473.0 0.002114 435.20807 456.71127
457.0 0.002188 434.95142 455.39810
465.0 0.002151 434.69470 453.62054
450.0 0.002222 434.43805 451.59473
458.0 0.002183 434.18140 449.52725
452.0 0.002212 433.92474 447.56879
452.0 0.002212 433.66809 445.84341
450.0 0.002222 433.41150 444.42538
436.0 0.002294 433.15472 443.20706
452.0 0.002212 432.89807 442.28461
440.0 0.002273 432.64142 441.58414
440.0 0.002273 432.38477 441.09940
438.0 0.002283 432.12811 440.81696
440.0 0.002273 431.87146 440.73395
440.0 0.002273 431.61472 440.85544
439.0 0.002278 431.35809 441.19672
447.0 0.002237 431.10144 441.63715
434.0 0.002304 430.84479 442.19464
437.0 0.002288 430.58813 442.72696
456.0 0.002193 430.33154 443.14725
448.0 0.002232 430.07474 443.46774
453.0 0.002208 429.81808 443.73077
457.0 0.002188 429.56146 443.95084
446.0 0.002242 429.30481 444.40918
452.0 0.002212 429.04816 445.10043
439.0 0.002278 428.79150 446.03894
443.0 0.002257 428.53485 447.18961
439.0 0.002278 428.27811 448.40411
439.0 0.002278 428.02145 449.41544
440.0 0.002273 427.76483 449.97986
432.0 0.002315 427.50818 449.85800
437.0 0.002288 427.25153 449.03357
443.0 0.002257 426.99493 447.70428
446.0 0.002242 426.73813 446.15448
436.0 0.002294 426.48148 444.56934
444.0 0.002252 426.22482 443.30368
454.0 0.002203 425.96820 442.44696
442.0 0.002262 425.71155 442.11682
439.0 0.002278 425.45490 442.22076
442.0 0.002262 425.19815 442.58469
444.0 0.002252 424.94150 443.23660
449.0 0.002227 424.68484 444.05518
455.0 0.002198 424.42819 444.86264
464.0 0.002155 424.17157 445.45981
452.0 0.002212 423.91498 445.66861
453.0 0.002208 423.65817 445.38937
449.0 0.002227 423.40152 444.62802
443.0 0.002257 423.14487 443.52057
444.0 0.002252 422.88821 442.10141
439.0 0.002278 422.63156 440.56445
436.0 0.002294 422.37494 439.03098
430.0 0.002326 422.11829 437.65094
437.0 0.002288 421.86154 436.43069
425.0 0.002353 421.60489 435.52417
431.0 0.002320 421.34824 434.91602
429.0 0.002331 421.09158 434.57208
438.0 0.002283 420.83493 434.42651
436.0 0.002294 420.57837 434.45139
436.0 0.002294 420.32156 434.53406
448.0 0.002232 420.06491 434.62766
425.0 0.002353 419.80826 434.78198
430.0 0.002326 419.55161 434.99457
436.0 0.002294 419.29495 435.30420
429.0 0.002331 419.03830 435.78888
432.0 0.002315 418.78159 436.49582
444.0 0.002252 418.52493 437.38623
440.0 0.002273 418.26828 438.40231
444.0 0.002252 418.01163 439.47827
446.0 0.002242 417.75497 440.59830
443.0 0.002257 417.49841 441.74100
437.0 0.002288 417.24161 442.91776
440.0 0.002273 416.98499 444.07013
452.0 . . .
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 PubChem 23280688
