#------------------------------------------------------------------------------
#$Date: 2016-03-26 17:19:08 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180387 $
#$URL: svn://www.crystallography.net/cod/cif/7/20/56/7205624.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_7205624
loop_
_publ_author_name
'Fujii, Kotaro'
'Uekusa, Hidehiro'
'Fukano, Michitaro'
'Koshima, Hideko'
_publ_section_title
;
 Metastable polymorphic form of isopropylbenzophenone derivative
 directly obtained by the solid-state photoreaction investigated by ab
 initio powder X-ray diffraction analysis
;
_journal_issue                   9
_journal_name_full               CrystEngComm
_journal_page_first              3197
_journal_paper_doi               10.1039/c0ce00500b
_journal_volume                  13
_journal_year                    2011
_chemical_formula_sum            'C31 H37 N O2'
_chemical_formula_weight         455.64
_chemical_name_common
'from C:/data/powder/koshima_ipbp/irr/rietveld/ipbp_irr_rrr.cif'
_chemical_name_systematic        ' ?'
_space_group_IT_number           19
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  'P 2ac 2ab'
_symmetry_space_group_name_H-M   'P 21 21 21'
_audit_creation_date             2009-09-22T16:59
_audit_creation_method           'from EXP file using GSAS2CIF'
_audit_update_record
' 2009-09-22T16:59 Initial CIF as created by GSAS2CIF'
_cell_angle_alpha                90.0
_cell_angle_beta                 90.0
_cell_angle_gamma                90.0
_cell_formula_units_Z            4
_cell_length_a                   20.0585(4)
_cell_length_b                   9.71812(17)
_cell_length_c                   13.84077(26)
_cell_measurement_temperature    20
_cell_volume                     2697.99(9)
_computing_structure_refinement  GSAS
_diffrn_ambient_temperature      20
_diffrn_radiation_polarisn_ratio 0.9
_diffrn_radiation_probe          x-ray
_diffrn_radiation_wavelength     1.19751
_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                     2009-09-22T16:59|IPBP_IRR||
_pd_calc_method                  'Rietveld Refinement'
_pd_instr_location               ' ?'
_pd_meas_2theta_range_inc        0.01
_pd_meas_2theta_range_max        55.0
_pd_meas_2theta_range_min        5.0
_pd_meas_number_of_points        5001
_pd_phase_name
'from C:/data/powder/koshima_ipbp/irr/rietveld/ipbp_irr_rrr.cif'
_pd_proc_2theta_range_inc        0.01
_pd_proc_2theta_range_max        54.997
_pd_proc_2theta_range_min        4.997
_pd_proc_info_datetime           2009-09-22T16:59:15
_pd_proc_info_excluded_regions   ' ?'
_pd_proc_ls_background_function
; GSAS Background function number 7 with 36 terms.
Linear interpolation
1: 5733.07 2: 5760.93 3: 6262.12 4: 6565.93
5: 7014.35 6: 7699.96 7: 8950.51 8: 11643.2
9: 12842.2 10: 12149.1 11: 9841.12 12: 8585.39
13: 7532.10 14: 6394.23 15: 5805.15 16: 5366.44
17: 4881.97 18: 4683.76 19: 4530.18 20: 4622.30
21: 4521.25 22: 4347.82 23: 4060.43 24: 3888.63
25: 3742.71 26: 3659.63 27: 3623.13 28: 3642.56
29: 3674.92 30: 3764.46 31: 3756.87 32: 3740.91
33: 3725.59 34: 3696.65 35: 3631.35 36: 3629.09
;
_pd_proc_ls_peak_cutoff          0.00100
_pd_proc_ls_pref_orient_corr
; March-Dollase
AXIS 1 Ratio= 0.95305 h= 0.000 k= 1.000 l= 0.000
Prefered orientation correction range: Min= 0.93042, Max= 1.15517
;
_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 0.0010 times the peak
Aniso. broadening axis 0.0 0.0 1.0
;
_pd_proc_ls_prof_R_factor        0.0340
_pd_proc_ls_prof_wR_expected     0.0118
_pd_proc_ls_prof_wR_factor       0.0521
_pd_proc_number_of_points        5001
_pd_spec_mounting                ' ?'
_refine_ls_goodness_of_fit_all   4.53
_refine_ls_matrix_type           full
_refine_ls_number_parameters     256
_refine_ls_number_restraints     232
_refine_ls_R_Fsqd_factor         0.09570
_refine_ls_shift/su_max          0.04
_refine_ls_shift/su_mean         0.01
_reflns_d_resolution_high        1.294
_reflns_d_resolution_low         11.392
_reflns_limit_h_max              15
_reflns_limit_h_min              0
_reflns_limit_k_max              7
_reflns_limit_k_min              0
_reflns_limit_l_max              10
_reflns_limit_l_min              0
_reflns_number_total             787
_cod_data_source_file            c0ce00500b.txt
_cod_data_source_block           IPBP_IRR_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 2.4.1 from 2010-06-29 (74
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 2.4.1 from 2010-06-29 (57 times).

Automatic conversion script
Id: cif_fix_enum 1555 2011-01-17 13:19:09Z saulius 
;
_cod_original_cell_volume        2697.99(13)
_cod_database_code               7205624
#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
2 +x+1/2,-y+1/2,-z
3 -x,+y+1/2,-z+1/2
4 -x+1/2,-y,+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_occupancy
_atom_site_thermal_displace_type
_atom_site_U_iso_or_equiv
_atom_site_symmetry_multiplicity
C C1 1.08814(26) 0.4376(6) -0.1743(5) 1.0 Uiso 0.0917(26) 4
C C2 1.12186(29) 0.3768(7) -0.2511(6) 1.0 Uiso 0.0917(26) 4
C C3 1.16470(27) 0.2665(6) -0.2348(5) 1.0 Uiso 0.0917(26) 4
C C4 1.17429(25) 0.2159(6) -0.1418(6) 1.0 Uiso 0.0917(26) 4
C C5 1.14068(23) 0.2769(5) -0.0650(5) 1.0 Uiso 0.0917(26) 4
C C6 1.09800(23) 0.3866(5) -0.0819(5) 1.0 Uiso 0.0917(26) 4
C C7 1.04161(27) 0.5590(7) -0.1923(7) 1.0 Uiso 0.0917(26) 4
C C8 1.0822(6) 0.6897(9) -0.2029(13) 1.0 Uiso 0.0917(26) 4
C C9 0.9962(7) 0.5429(14) -0.2793(11) 1.0 Uiso 0.0917(26) 4
C C10 1.19942(32) 0.2058(8) -0.3225(5) 1.0 Uiso 0.0917(26) 4
C C11 1.2738(4) 0.2353(16) -0.3229(9) 1.0 Uiso 0.0917(26) 4
C C12 1.1850(7) 0.0531(8) -0.3314(12) 1.0 Uiso 0.0917(26) 4
C C13 1.12796(20) 0.2783(4) 0.0432(5) 1.0 Uiso 0.0917(26) 4
C C14 1.1890(4) 0.3169(12) 0.1052(9) 1.0 Uiso 0.0917(26) 4
C C15 1.0957(6) 0.1457(8) 0.0827(9) 1.0 Uiso 0.0917(26) 4
C C16 1.07741(19) 0.40731(31) 0.0225(5) 1.0 Uiso 0.0917(26) 4
C C17 1.00427(26) 0.3693(4) 0.0482(5) 1.0 Uiso 0.0917(26) 4
C C18 0.9665(5) 0.3234(5) -0.0293(6) 1.0 Uiso 0.0917(26) 4
C C19 0.9003(5) 0.2847(4) -0.0165(7) 1.0 Uiso 0.0917(26) 4
C C20 0.87132(34) 0.2913(4) 0.0743(9) 1.0 Uiso 0.0917(26) 4
C C21 0.90874(31) 0.3368(4) 0.1523(7) 1.0 Uiso 0.0917(26) 4
C C22 0.97478(25) 0.3754(4) 0.1392(4) 1.0 Uiso 0.0917(26) 4
C C23 1.01402(24) 0.4242(5) 0.2247(4) 1.0 Uiso 0.0917(26) 4
C C24 1.05036(31) 0.3741(9) 0.39100(26) 1.0 Uiso 0.0917(26) 4
C C25 1.0123(6) 0.3139(14) 0.4758(7) 1.0 Uiso 0.0917(26) 4
C C26 1.12200(31) 0.3236(8) 0.38895(21) 1.0 Uiso 0.0917(26) 4
C C27 1.1738(5) 0.4181(8) 0.39473(21) 1.0 Uiso 0.0917(26) 4
C C28 1.2395(4) 0.3732(12) 0.39298(22) 1.0 Uiso 0.0917(26) 4
C C29 1.2528(4) 0.2336(13) 0.38554(22) 1.0 Uiso 0.0917(26) 4
C C30 1.2007(5) 0.1394(9) 0.37979(21) 1.0 Uiso 0.0917(26) 4
C C31 1.1350(5) 0.1836(8) 0.38149(21) 1.0 Uiso 0.0917(26) 4
O O32 1.0980(5) 0.5388(7) 0.0595(8) 1.0 Uiso 0.0917(26) 4
O O33 1.04389(34) 0.5348(7) 0.2240(8) 1.0 Uiso 0.0917(26) 4
N N34 1.0140(6) 0.3409(9) 0.3017(5) 1.0 Uiso 0.0917(26) 4
H H35 1.0132(6) 0.5695(15) -0.1351(10) 1.0 Uiso 0.183(4) 4
H H36 1.090(15) 0.708(19) -0.2702(20) 1.0 Uiso 0.183(4) 4
H H37 1.058(8) 0.765(6) -0.175(22) 1.0 Uiso 0.183(4) 4
H H38 1.124(7) 0.679(13) -0.170(22) 1.0 Uiso 0.183(4) 4
H H39 0.961(8) 0.609(21) -0.276(11) 1.0 Uiso 0.183(4) 4
H H40 1.0214(35) 0.557(30) -0.3374(12) 1.0 Uiso 0.183(4) 4
H H41 0.978(12) 0.452(10) -0.280(12) 1.0 Uiso 0.183(4) 4
H H42 1.1158(4) 0.4099(10) -0.3135(6) 1.0 Uiso 0.183(4) 4
H H43 1.1805(7) 0.2506(15) -0.3798(7) 1.0 Uiso 0.183(4) 4
H H44 1.2975(14) 0.157(14) -0.299(25) 1.0 Uiso 0.183(4) 4
H H45 1.2880(34) 0.25(4) -0.388(4) 1.0 Uiso 0.183(4) 4
H H46 1.2829(24) 0.313(24) -0.282(21) 1.0 Uiso 0.183(4) 4
H H47 1.221(8) 0.0018(15) -0.303(20) 1.0 Uiso 0.183(4) 4
H H48 1.144(8) 0.032(6) -0.298(19) 1.0 Uiso 0.183(4) 4
H H49 1.181(15) 0.029(6) -0.3984(18) 1.0 Uiso 0.183(4) 4
H H50 1.20293(28) 0.1422(6) -0.1311(9) 1.0 Uiso 0.183(4) 4
H H51 1.176(4) 0.320(32) 0.1720(24) 1.0 Uiso 0.183(4) 4
H H52 1.223(6) 0.249(18) 0.096(18) 1.0 Uiso 0.183(4) 4
H H53 1.205(10) 0.405(15) 0.086(15) 1.0 Uiso 0.183(4) 4
H H54 1.099(15) 0.074(10) 0.036(10) 1.0 Uiso 0.183(4) 4
H H55 1.118(11) 0.118(20) 0.141(14) 1.0 Uiso 0.183(4) 4
H H56 1.049(4) 0.162(10) 0.096(24) 1.0 Uiso 0.183(4) 4
H H57 1.0900(16) 0.5422(26) 0.1271(12) 1.0 Uiso 0.183(4) 4
H H58 0.9857(8) 0.3184(7) -0.0904(6) 1.0 Uiso 0.183(4) 4
H H59 0.8754(7) 0.2542(5) -0.0690(9) 1.0 Uiso 0.183(4) 4
H H60 0.8270(4) 0.2657(5) 0.0828(12) 1.0 Uiso 0.183(4) 4
H H61 0.8896(5) 0.3418(6) 0.2134(8) 1.0 Uiso 0.183(4) 4
H H62 0.99354(32) 0.2680(7) 0.2986(7) 1.0 Uiso 0.183(4) 4
H H63 1.0510(6) 0.4744(9) 0.3982(8) 1.0 Uiso 0.183(4) 4
H H64 1.008(14) 0.216(5) 0.468(12) 1.0 Uiso 0.183(4) 4
H H65 1.036(8) 0.333(29) 0.5346(24) 1.0 Uiso 0.183(4) 4
H H66 0.969(6) 0.354(25) 0.479(14) 1.0 Uiso 0.183(4) 4
H H67 1.1645(8) 0.5115(8) 0.39974(25) 1.0 Uiso 0.183(4) 4
H H68 1.2743(6) 0.4362(17) 0.39681(26) 1.0 Uiso 0.183(4) 4
H H69 1.2967(5) 0.2031(19) 0.38432(27) 1.0 Uiso 0.183(4) 4
H H70 1.2100(8) 0.0459(10) 0.37477(26) 1.0 Uiso 0.183(4) 4
H H71 1.1003(6) 0.1205(12) 0.37767(25) 1.0 Uiso 0.183(4) 4
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
C 124.0 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
O 8.0 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
N 4.0 0.000 0.000 12.2126 0.00570 3.13220 9.89330 2.01250 28.9975 1.16630
0.58260 -11.529 International_Tables_Vol_C
H 148.0 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_
_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
C2 C1 C6 118.91(34) 1_555 . 1_555 n
C2 C1 C7 120.1(4) 1_555 . 1_555 n
C6 C1 C7 120.9(4) 1_555 . 1_555 n
C1 C2 C3 120.2(4) 1_555 . 1_555 n
C2 C3 C4 120.47(34) 1_555 . 1_555 n
C2 C3 C10 116.9(4) 1_555 . 1_555 n
C4 C3 C10 122.6(4) 1_555 . 1_555 n
C3 C4 C5 119.27(35) 1_555 . 1_555 n
C4 C5 C6 119.9(4) 1_555 . 1_555 n
C4 C5 C13 146.9(4) 1_555 . 1_555 n
C6 C5 C13 93.16(29) 1_555 . 1_555 n
C1 C6 C5 121.21(33) 1_555 . 1_555 n
C1 C6 C16 142.5(4) 1_555 . 1_555 n
C5 C6 C16 96.31(29) 1_555 . 1_555 n
C1 C7 C8 109.6(5) 1_555 . 1_555 n
C1 C7 C9 114.6(5) 1_555 . 1_555 n
C8 C7 C9 109.3(7) 1_555 . 1_555 n
C3 C10 C11 112.3(5) 1_555 . 1_555 n
C3 C10 C12 110.9(5) 1_555 . 1_555 n
C11 C10 C12 111.8(7) 1_555 . 1_555 n
C5 C13 C14 114.7(5) 1_555 . 1_555 n
C5 C13 C15 114.4(5) 1_555 . 1_555 n
C5 C13 C16 86.46(27) 1_555 . 1_555 n
C14 C13 C15 109.8(5) 1_555 . 1_555 n
C14 C13 C16 113.8(4) 1_555 . 1_555 n
C15 C13 C16 116.2(4) 1_555 . 1_555 n
C6 C16 C13 84.07(26) 1_555 . 1_555 n
C6 C16 C17 116.4(4) 1_555 . 1_555 n
C6 C16 O32 112.3(4) 1_555 . 1_555 n
C13 C16 C17 111.25(24) 1_555 . 1_555 n
C13 C16 O32 116.1(4) 1_555 . 1_555 n
C17 C16 O32 113.6(4) 1_555 . 1_555 n
C16 C17 C18 114.5(6) 1_555 . 1_555 n
C16 C17 C22 126.7(5) 1_555 . 1_555 n
C18 C17 C22 118.8(4) 1_555 . 1_555 n
C17 C18 C19 120.6(4) 1_555 . 1_555 n
C18 C19 C20 120.2(4) 1_555 . 1_555 n
C19 C20 C21 119.6(4) 1_555 . 1_555 n
C20 C21 C22 120.0(4) 1_555 . 1_555 n
C17 C22 C21 120.8(4) 1_555 . 1_555 n
C17 C22 C23 120.3(4) 1_555 . 1_555 n
C21 C22 C23 118.9(4) 1_555 . 1_555 n
C22 C23 O33 121.7(4) 1_555 . 1_555 n
C22 C23 N34 116.0(4) 1_555 . 1_555 n
O33 C23 N34 122.3(5) 1_555 . 1_555 n
C25 C24 C26 111.5(5) 1_555 . 1_555 n
C25 C24 N34 108.4(5) 1_555 . 1_555 n
C26 C24 N34 112.5(5) 1_555 . 1_555 n
C24 C26 C27 119.6(5) 1_555 . 1_555 n
C24 C26 C31 119.7(5) 1_555 . 1_555 n
C27 C26 C31 120.7(4) 1_555 . 1_555 n
C26 C27 C28 120.1(4) 1_555 . 1_555 n
C27 C28 C29 119.5(4) 1_555 . 1_555 n
C28 C29 C30 120.2(4) 1_555 . 1_555 n
C29 C30 C31 120.6(4) 1_555 . 1_555 n
C26 C31 C30 118.9(4) 1_555 . 1_555 n
C23 N34 C24 122.5(4) 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_1
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
C1 C2 1.391(4) . 1_555 n
C1 C6 1.3862(35) . 1_555 n
C1 C7 1.524(4) . 1_555 n
C2 C1 1.391(4) . 1_555 n
C2 C3 1.392(4) . 1_555 n
C3 C2 1.392(4) . 1_555 n
C3 C4 1.392(4) . 1_555 n
C3 C10 1.519(4) . 1_555 n
C4 C3 1.392(4) . 1_555 n
C4 C5 1.3906(35) . 1_555 n
C5 C4 1.3906(35) . 1_555 n
C5 C6 1.3872(34) . 1_555 n
C5 C13 1.5196(35) . 1_555 n
C6 C1 1.3862(35) . 1_555 n
C6 C5 1.3872(34) . 1_555 n
C6 C16 1.5156(34) . 1_555 n
C7 C1 1.524(4) . 1_555 n
C7 C8 1.517(4) . 1_555 n
C7 C9 1.519(4) . 1_555 n
C8 C7 1.517(4) . 1_555 n
C9 C7 1.519(4) . 1_555 n
C10 C3 1.519(4) . 1_555 n
C10 C11 1.519(4) . 1_555 n
C10 C12 1.517(4) . 1_555 n
C11 C10 1.519(4) . 1_555 n
C12 C10 1.517(4) . 1_555 n
C13 C5 1.5196(35) . 1_555 n
C13 C14 1.542(4) . 1_555 n
C13 C15 1.543(4) . 1_555 n
C13 C16 1.6375(34) . 1_555 n
C14 C13 1.542(4) . 1_555 n
C15 C13 1.543(4) . 1_555 n
C16 C6 1.5156(34) . 1_555 n
C16 C13 1.6375(34) . 1_555 n
C16 C17 1.5544(34) . 1_555 n
C16 O32 1.437(4) . 1_555 n
C17 C16 1.5544(34) . 1_555 n
C17 C18 1.387(7) . 1_555 n
C17 C22 1.392(4) . 1_555 n
C18 C17 1.387(7) . 1_555 n
C18 C19 1.391(4) . 1_555 n
C19 C18 1.391(4) . 1_555 n
C19 C20 1.387(4) . 1_555 n
C20 C19 1.387(4) . 1_555 n
C20 C21 1.387(4) . 1_555 n
C21 C20 1.387(4) . 1_555 n
C21 C22 1.389(4) . 1_555 n
C22 C17 1.392(4) . 1_555 n
C22 C21 1.389(4) . 1_555 n
C22 C23 1.4985(35) . 1_555 n
C23 C22 1.4985(35) . 1_555 n
C23 O33 1.231(4) . 1_555 n
C23 N34 1.3387(35) . 1_555 n
C24 C25 1.518(4) . 1_555 n
C24 C26 1.5186(34) . 1_555 n
C24 N34 1.4704(35) . 1_555 n
C25 C24 1.518(4) . 1_555 n
C26 C24 1.5186(34) . 1_555 n
C26 C27 1.389(4) . 1_555 n
C26 C31 1.389(4) . 1_555 n
C27 C26 1.389(4) . 1_555 n
C27 C28 1.387(4) . 1_555 n
C28 C27 1.387(4) . 1_555 n
C28 C29 1.386(4) . 1_555 n
C29 C28 1.386(4) . 1_555 n
C29 C30 1.392(4) . 1_555 n
C30 C29 1.392(4) . 1_555 n
C30 C31 1.387(4) . 1_555 n
C31 C26 1.389(4) . 1_555 n
C31 C30 1.387(4) . 1_555 n
O32 C16 1.437(4) . 1_555 n
O33 C23 1.231(4) . 1_555 n
N34 C23 1.3387(35) . 1_555 n
N34 C24 1.4704(35) . 1_555 n
loop_
_pd_meas_counts_total
_pd_proc_ls_weight
_pd_proc_intensity_bkg_calc
_pd_calc_intensity_total
5855.0 0.0001708 5733.06982 5733.06689
5691.0 0.0001757 5733.26465 5733.26221
5598.0 0.0001786 5733.45996 5733.45703
5698.0 0.0001755 5733.65479 5733.65234
5707.0 0.0001752 5733.85010 5733.84717
5713.0 0.0001750 5734.04492 5734.04248
5587.0 0.0001790 5734.24023 5734.23730
5766.0 0.0001734 5734.43506 5734.43262
5621.0 0.0001779 5734.63037 5734.62744
5546.0 0.0001803 5734.82520 5734.82275
5642.0 0.0001772 5735.02051 5735.01758
5677.0 0.0001761 5735.21533 5735.21289
5681.0 0.0001760 5735.41064 5735.40820
5672.0 0.0001763 5735.60547 5735.60303
5666.0 0.0001765 5735.80078 5735.79834
5710.0 0.0001751 5735.99561 5735.99316
5579.0 0.0001792 5736.19092 5736.18848
5675.0 0.0001762 5736.38574 5736.38330
5647.0 0.0001771 5736.58105 5736.57861
5658.0 0.0001767 5736.77588 5736.77344
5649.0 0.0001770 5736.97119 5736.96875
5568.0 0.0001796 5737.16602 5737.16406
5561.0 0.0001798 5737.36133 5737.35889
5637.0 0.0001774 5737.55615 5737.55420
5698.0 0.0001755 5737.75146 5737.74902
5584.0 0.0001791 5737.94629 5737.94434
5660.0 0.0001767 5738.14160 5738.13916
5666.0 0.0001765 5738.33643 5738.33447
5717.0 0.0001749 5738.53174 5738.52930
5604.0 0.0001784 5738.72656 5738.72461
5756.0 0.0001737 5738.92188 5738.91943
5618.0 0.0001780 5739.11670 5739.11475
5766.0 0.0001734 5739.31201 5739.31006
5686.0 0.0001759 5739.50684 5739.50488
5659.0 0.0001767 5739.70215 5739.70020
5673.0 0.0001763 5739.89697 5739.89502
5733.0 0.0001744 5740.09180 5740.09033
5697.0 0.0001755 5740.28711 5740.28516
5664.0 0.0001766 5740.48193 5740.48047
5758.0 0.0001737 5740.67725 5740.67529
5776.0 0.0001731 5740.87207 5740.87061
5746.0 0.0001740 5741.06738 5741.06543
5881.0 0.0001700 5741.26221 5741.26074
5712.0 0.0001751 5741.45752 5741.45605
5761.0 0.0001736 5741.65234 5741.65088
5706.0 0.0001753 5741.84766 5741.84619
5778.0 0.0001731 5742.04248 5742.04102
5707.0 0.0001752 5742.23779 5742.23633
5683.0 0.0001760 5742.43262 5742.43115
5583.0 0.0001791 5742.62793 5742.62646
5741.0 0.0001742 5742.82275 5742.82129
5711.0 0.0001751 5743.01807 5743.01660
5744.0 0.0001741 5743.21289 5743.21191
5835.0 0.0001714 5743.40820 5743.40674
5914.0 0.0001691 5743.60303 5743.60205
5694.0 0.0001756 5743.79834 5743.79688
5726.0 0.0001746 5743.99316 5743.99219
5705.0 0.0001753 5744.18848 5744.18701
5632.0 0.0001776 5744.38330 5744.38232
5779.0 0.0001730 5744.57861 5744.57715
5782.0 0.0001730 5744.77344 5744.77246
5746.0 0.0001740 5744.96875 5785.25000
5804.0 0.0001723 5745.16357 5787.66113
5799.0 0.0001724 5745.35889 5790.26025
5773.0 0.0001732 5745.55371 5793.06885
5829.0 0.0001716 5745.74902 5796.11328
5922.0 0.0001689 5745.94385 5799.42139
5904.0 0.0001694 5746.13916 5803.02832
5957.0 0.0001679 5746.33398 5806.97217
5950.0 0.0001681 5746.52930 5811.30029
5907.0 0.0001693 5746.72412 5816.06592
5931.0 0.0001686 5746.91943 5821.33398
5915.0 0.0001691 5747.11426 5827.18115
5851.0 0.0001709 5747.30908 5833.69727
5923.0 0.0001688 5747.50439 5840.99512
5941.0 0.0001683 5747.69922 5849.20703
5952.0 0.0001680 5747.89453 5858.49902
6013.0 0.0001663 5748.08936 5869.07373
6129.0 0.0001632 5748.28467 5881.18506
6021.0 0.0001661 5748.47949 5895.15234
6103.0 0.0001639 5748.67480 5911.38477
5973.0 0.0001674 5748.86963 5930.40820
6046.0 0.0001654 5749.06494 5952.91406
6197.0 0.0001614 5749.25977 5979.82080
6230.0 0.0001605 5749.45508 6012.37305
6366.0 0.0001571 5749.64990 6052.29346
6364.0 0.0001571 5749.84521 6102.01953
6389.0 0.0001565 5750.04004 6165.09717
6363.0 0.0001572 5750.23535 6246.85107
6522.0 0.0001533 5750.43018 6355.58984
6716.0 0.0001489 5750.62549 6504.89551
6917.0 0.0001446 5750.82031 6718.55176
7270.0 0.0001376 5751.01563 7045.55566
8043.0 0.0001243 5751.21045 7622.86182
9280.0 0.0001078 5751.40576 8855.40918
11453.0 0.0000873 5751.60059 11579.55566
15148.0 0.0000660 5751.79590 16547.63672
21288.0 0.0000470 5751.99072 23601.51758
29674.0 0.00003370 5752.18604 31943.53125
37791.0 0.00002646 5752.38086 36154.82813
38421.0 0.00002603 5752.57617 35447.37891
28120.0 0.0000356 5752.77100 25023.51953
16060.0 0.0000623 5752.96631 14890.41797
10725.0 0.0000932 5753.16113 10018.61816
8527.0 0.0001173 5753.35645 8181.42627
7350.0 0.0001361 5753.55127 7391.39209
6965.0 0.0001436 5753.74658 6949.11523
6615.0 0.0001512 5753.94141 6665.89746
6547.0 0.0001527 5754.13623 6472.79736
6294.0 0.0001589 5754.33154 6335.28809
6322.0 0.0001582 5754.52637 6233.92969
6248.0 0.0001601 5754.72168 6157.08740
6169.0 0.0001621 5754.91650 6097.45508
6144.0 0.0001628 5755.11182 6050.25928
6153.0 0.0001625 5755.30664 6012.27393
5969.0 0.0001675 5755.50195 5981.25586
5998.0 0.0001667 5755.69678 5955.60547
6033.0 0.0001658 5755.89209 5934.15771
5920.0 0.0001689 5756.08691 5916.04834
6099.0 0.0001640 5756.28223 5900.62305
6022.0 0.0001661 5756.47705 5887.38135
5959.0 0.0001678 5756.67236 5875.93408
6178.0 0.0001619 5756.86719 5865.97559
6109.0 0.0001637 5757.06250 5857.26172
6087.0 0.0001643 5757.25732 5849.59668
6050.0 0.0001653 5757.45264 5842.82275
5914.0 0.0001691 5757.64746 5836.80908
5974.0 0.0001674 5757.84277 5831.44971
5994.0 0.0001668 5758.03760 5871.97900
6063.0 0.0001649 5758.23291 5869.44775
5983.0 0.0001671 5758.42773 5867.45068
6049.0 0.0001653 5758.62305 5865.94385
6099.0 0.0001640 5758.81787 5864.89209
5990.0 0.0001669 5759.01318 5864.26855
5973.0 0.0001674 5759.20801 5864.04980
5960.0 0.0001678 5759.40332 5864.22168
6045.0 0.0001654 5759.59814 5864.77393
6059.0 0.0001650 5759.79346 5865.70020
6100.0 0.0001639 5759.98828 5829.05811
6064.0 0.0001649 5760.18359 5832.60938
6078.0 0.0001645 5760.37842 5836.41211
5939.0 0.0001684 5760.57373 5840.49121
5982.0 0.0001672 5760.76855 5844.87598
5956.0 0.0001679 5761.53174 5850.16699
6085.0 0.0001643 5765.04102 5858.58008
6021.0 0.0001661 5768.54980 5867.41211
6096.0 0.0001640 5772.05859 5876.71143
5986.0 0.0001671 5775.56787 5886.53516
6046.0 0.0001654 5779.07666 5896.94873
5994.0 0.0001668 5782.58594 5908.02783
5974.0 0.0001674 5786.09473 5919.86133
5980.0 0.0001672 5789.60400 5932.55176
6021.0 0.0001661 5793.11279 5946.22266
6050.0 0.0001653 5796.62207 5961.01709
6115.0 0.0001635 5800.13086 5977.10840
6032.0 0.0001658 5803.64014 5994.70264
6101.0 0.0001639 5807.14893 6014.05029
6175.0 0.0001619 5810.65820 6035.45508
5993.0 0.0001669 5814.16699 6059.28955
6181.0 0.0001618 5817.67627 6086.01514
6252.0 0.0001599 5821.18506 6116.20752
6235.0 0.0001604 5824.69434 6150.59619
6229.0 0.0001605 5828.20313 6190.10938
6320.0 0.0001582 5831.71240 6235.95166
6338.0 0.0001578 5835.22119 6289.70215
6387.0 0.0001566 5838.73047 6353.46729
6442.0 0.0001552 5842.23926 6430.10742
6524.0 0.0001533 5845.74854 6523.58838
6533.0 0.0001531 5849.25732 6639.53418
6598.0 0.0001516 5852.76660 6786.14893
6793.0 0.0001472 5856.27539 6975.78076
6974.0 0.0001434 5859.78467 7227.74219
7138.0 0.0001401 5863.29346 7573.66699
7688.0 0.0001301 5866.80273 8068.66943
8488.0 0.0001178 5870.31152 8822.24219
9963.0 0.0001004 5873.82080 10135.76465
13113.0 0.0000763 5877.33008 13025.10645
18880.0 0.0000530 5880.83887 20041.70508
29578.0 0.00003381 5884.34766 34455.56250
48362.0 0.00002068 5887.85693 56294.48047
73306.0 0.00001364 5891.36572 80386.91406
94337.0 0.00001060 5894.87500 90620.71094
91024.0 0.00001099 5898.38379 77215.68750
53365.0 0.00001874 5901.89307 43484.08594
22864.0 0.0000437 5905.40186 21781.90234
12512.0 0.0000799 5908.91113 13470.27832
9178.0 0.0001090 5912.41992 10541.35742
7768.0 0.0001287 5915.92920 9151.16602
7036.0 0.0001421 5919.43799 8318.89160
6473.0 0.0001545 5922.94727 7773.39844
6331.0 0.0001580 5926.45605 7396.84424
6401.0 0.0001562 5929.96533 7126.45703
6209.0 0.0001611 5933.47412 6926.09521
6211.0 0.0001610 5936.98340 6773.77002
6229.0 0.0001605 5940.49219 6655.48975
6194.0 0.0001614 5944.00146 6562.01025
6109.0 0.0001637 5947.51025 6487.02344
6299.0 0.0001588 5951.01953 6426.10791
6173.0 0.0001620 5954.52832 6376.08887
6207.0 0.0001611 5958.03760 6334.63867
6137.0 0.0001629 5961.54639 6300.02100
5972.0 0.0001674 5965.05566 6270.91699
5977.0 0.0001673 5968.56445 6246.31299
6076.0 0.0001646 5972.07373 6225.41553
6141.0 0.0001628 5975.58252 6207.60205
5939.0 0.0001684 5979.09180 6192.37256
6085.0 0.0001643 5982.60059 6179.32568
6019.0 0.0001661 5986.10986 6168.13574
6087.0 0.0001643 5989.61865 6158.53418
6130.0 0.0001631 5993.12793 6150.30078
6099.0 0.0001640 5996.63672 6143.25049
6098.0 0.0001640 6000.14600 6137.23047
5989.0 0.0001670 6003.65479 6132.11035
6020.0 0.0001661 6007.16406 6127.78027
6063.0 0.0001649 6010.67285 6124.14697
6086.0 0.0001643 6014.18213 6121.12988
5978.0 0.0001673 6017.69092 6118.65967
6079.0 0.0001645 6021.20020 6116.67822
6174.0 0.0001620 6024.70898 6115.13232
6015.0 0.0001663 6028.21826 6113.97803
6038.0 0.0001656 6031.72705 6113.17480
6169.0 0.0001621 6035.23633 6112.68994
6125.0 0.0001633 6038.74512 6112.49072
6053.0 0.0001652 6042.25439 6112.55273
6123.0 0.0001633 6045.76318 6112.85010
6045.0 0.0001654 6049.27246 6113.36279
6057.0 0.0001651 6052.78125 6114.07227
6099.0 0.0001640 6056.29053 6114.96094
6163.0 0.0001623 6059.79932 6131.36963
6196.0 0.0001614 6063.30859 6133.17041
6084.0 0.0001644 6066.81738 6135.14551
5956.0 0.0001679 6070.32666 6137.28711
6102.0 0.0001639 6073.83545 6139.58740
6110.0 0.0001637 6077.34473 6142.04297
6165.0 0.0001622 6080.85352 6100.37891
6134.0 0.0001630 6084.36279 6104.74658
6210.0 0.0001610 6087.87158 6109.17188
6119.0 0.0001634 6091.38086 6113.66064
6119.0 0.0001634 6094.88965 6118.21875
6198.0 0.0001613 6098.39893 6122.85205
6187.0 0.0001616 6101.90771 6127.56934
6217.0 0.0001608 6105.41650 6132.37793
6250.0 0.0001600 6108.92578 6137.28809
6092.0 0.0001641 6112.43457 6142.31006
6193.0 0.0001615 6115.94385 6147.45654
6204.0 0.0001612 6119.45264 6152.74219
6189.0 0.0001616 6122.96191 6158.18164
6215.0 0.0001609 6126.47070 6163.79395
6199.0 0.0001613 6129.97998 6169.60107
6189.0 0.0001616 6133.48877 6175.62695
6105.0 0.0001638 6136.99805 6181.90039
6179.0 0.0001618 6140.50732 6188.45557
6136.0 0.0001630 6144.01611 6195.33154
6198.0 0.0001613 6147.52539 6202.57471
6289.0 0.0001590 6151.03418 6210.24072
6296.0 0.0001588 6154.54346 6218.39746
6237.0 0.0001603 6158.05225 6227.12305
6273.0 0.0001594 6161.56152 6236.51563
6230.0 0.0001605 6165.07031 6246.69336
6192.0 0.0001615 6168.57959 6257.80322
6285.0 0.0001591 6172.08838 6270.02686
6258.0 0.0001598 6175.59766 6283.59424
6323.0 0.0001582 6179.10645 6298.79492
6239.0 0.0001603 6182.61572 6316.00391
6358.0 0.0001573 6186.12451 6335.71094
6371.0 0.0001570 6189.63379 6358.56104
6395.0 0.0001564 6193.14258 6385.42627
6440.0 0.0001553 6196.65186 6417.50098
6339.0 0.0001578 6200.16064 6456.46191
6494.0 0.0001540 6203.66992 6504.71924
6574.0 0.0001521 6207.17871 6565.84229
6687.0 0.0001495 6210.68799 6645.29834
6891.0 0.0001451 6214.19678 6751.81055
7032.0 0.0001422 6217.70557 6900.02051
7156.0 0.0001397 6221.21484 7116.57275
7594.0 0.0001317 6224.72363 7461.11865
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34100.0 0.00002933 6245.77783 34444.17188
35163.0 0.00002844 6249.28711 31698.14844
24825.0 0.0000403 6252.79590 20934.17773
14503.0 0.0000690 6256.30518 12760.17285
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8166.0 0.0001225 6264.97656 7466.81348
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7436.0 0.0001345 6269.23047 6947.17529
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6933.0 0.0001442 6273.48486 6708.05225
6745.0 0.0001483 6275.61182 6635.10693
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6369.0 0.0001570 6284.12061 6478.67578
6522.0 0.0001533 6286.24756 6457.64355
6418.0 0.0001558 6288.37451 6440.60986
6482.0 0.0001543 6290.50146 6426.71240
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6452.0 0.0001550 6294.75586 6405.92285
6374.0 0.0001569 6296.88281 6398.17480
6430.0 0.0001555 6299.00977 6391.77930
6328.0 0.0001580 6301.13721 6386.51025
6398.0 0.0001563 6303.26416 6382.18701
6470.0 0.0001546 6305.39160 6392.21924
6294.0 0.0001589 6307.51855 6389.90967
6361.0 0.0001572 6309.64551 6388.22314
6445.0 0.0001552 6311.77246 6387.08496
6483.0 0.0001542 6313.89990 6386.43457
6505.0 0.0001537 6316.02686 6386.22412
6368.0 0.0001570 6318.15381 6386.41504
6318.0 0.0001583 6320.28125 6386.97559
6431.0 0.0001555 6322.40820 6387.88574
6430.0 0.0001555 6324.53516 6389.12598
6355.0 0.0001574 6326.66211 6390.68799
6432.0 0.0001555 6328.78955 6392.56689
6564.0 0.0001523 6330.91650 6394.76465
6400.0 0.0001562 6333.04346 6397.29004
6466.0 0.0001547 6335.17041 6400.15625
6220.0 0.0001608 6337.29785 6403.38818
6441.0 0.0001553 6339.42480 6407.01807
6402.0 0.0001562 6341.55176 6411.09180
6377.0 0.0001568 6343.67920 6415.66846
6321.0 0.0001582 6345.80615 6420.83008
6389.0 0.0001565 6347.93311 6426.68604
6221.0 0.0001607 6350.06055 6433.38330
6384.0 0.0001566 6352.18750 6441.12549
6519.0 0.0001534 6354.31445 6450.20068
6460.0 0.0001548 6356.44189 6461.02393
6467.0 0.0001546 6358.56885 6474.21680
6434.0 0.0001554 6360.69580 6490.74219
6480.0 0.0001543 6362.82275 6512.17529
6454.0 0.0001549 6364.95020 6525.96143
6504.0 0.0001538 6367.07715 6569.53271
6564.0 0.0001523 6369.20410 6644.90820
6734.0 0.0001485 6371.33105 6801.08984
7186.0 0.0001392 6373.45850 7124.88574
7473.0 0.0001338 6375.58545 7676.13379
8109.0 0.0001233 6377.71240 8383.24414
8706.0 0.0001149 6379.83984 9277.32227
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8176.0 0.0001223 6384.09375 8362.86523
7450.0 0.0001342 6386.22070 7438.66162
6893.0 0.0001451 6388.34814 6999.85400
6756.0 0.0001480 6390.47510 6850.28174
6707.0 0.0001491 6392.60254 6812.33691
6710.0 0.0001490 6394.72949 6820.56006
6704.0 0.0001492 6396.85645 6859.91699
6826.0 0.0001465 6398.98340 6930.72119
6887.0 0.0001452 6401.11084 7041.64014
6924.0 0.0001444 6403.23779 7212.87646
7426.0 0.0001347 6405.36475 7494.76563
7942.0 0.0001259 6407.49170 8039.77002
9118.0 0.0001097 6409.61914 9245.87793
11247.0 0.0000889 6411.74609 11775.31055
15235.0 0.0000656 6413.87305 15978.29590
20844.0 0.0000480 6416.00049 21343.20508
26276.0 0.0000381 6418.12744 27402.23047
26641.0 0.0000375 6420.25439 26113.74219
19298.0 0.0000518 6422.38135 18127.40234
12610.0 0.0000793 6424.50879 11979.19141
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8186.0 0.0001222 6428.76318 8018.47217
7898.0 0.0001266 6430.89014 7518.47217
7602.0 0.0001315 6433.01709 7233.74707
7442.0 0.0001344 6435.14404 7049.93652
7235.0 0.0001382 6437.27148 6924.06689
7183.0 0.0001392 6439.39844 6834.38916
7072.0 0.0001414 6441.52539 6768.47510
6912.0 0.0001447 6443.65234 6783.11182
6923.0 0.0001444 6445.77979 6747.35596
6834.0 0.0001463 6447.90674 6720.05469
6758.0 0.0001480 6450.03369 6699.08447
6709.0 0.0001491 6452.16113 6682.96777
6853.0 0.0001459 6454.28809 6670.65039
6723.0 0.0001487 6456.41504 6661.36963
6872.0 0.0001455 6458.54199 6654.56250
6773.0 0.0001476 6460.66943 6649.81006
6703.0 0.0001492 6462.79639 6646.79492
6594.0 0.0001517 6464.92383 6645.28174
6543.0 0.0001528 6467.05078 6645.08838
6826.0 0.0001465 6469.17773 6646.08203
6786.0 0.0001474 6471.30469 6648.16455
6795.0 0.0001472 6473.43213 6651.26611
6793.0 0.0001472 6475.55908 6655.34229
6670.0 0.0001499 6477.68604 6660.37207
6771.0 0.0001477 6479.81299 6666.34912
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3724.0 . . .
