#------------------------------------------------------------------------------
#$Date: 2024-02-04 13:34:59 +0200 (Sun, 04 Feb 2024) $
#$Revision: 289431 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/57/05/1570540.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_1570540
loop_
_publ_author_name
'Hasebe, Shodai'
'Hagiwara, Yuki'
'Ueno, Takashi'
'Asahi, Toru'
'Koshima, Hideko'
_publ_section_title
;
 Negative to positive axial thermal expansion switching of an organic
 crystal: contribution to multistep photoactuation.
;
_journal_issue                   3
_journal_name_full               'Chemical science'
_journal_page_first              1088
_journal_page_last               1097
_journal_paper_doi               10.1039/d3sc04796b
_journal_volume                  15
_journal_year                    2024
_chemical_formula_moiety         'C21 H26 N2 O3'
_chemical_formula_sum            'C21 H26 N2 O3'
_chemical_formula_weight         354.44
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     dual
_audit_creation_date             2022-06-06
_audit_creation_method
;
Olex2 1.5
(compiled 2022.04.07 svn.rca3783a0 for OlexSys, GUI svn.r6498)
;
_audit_update_record
;
2023-08-31 deposited with the CCDC.	2023-12-11 downloaded from the CCDC.
;
_cell_angle_alpha                101.079(7)
_cell_angle_beta                 92.174(6)
_cell_angle_gamma                101.364(7)
_cell_formula_units_Z            2
_cell_length_a                   6.0405(8)
_cell_length_b                   10.3230(13)
_cell_length_c                   16.826(2)
_cell_measurement_reflns_used    7419
_cell_measurement_temperature    313.55
_cell_measurement_theta_max      68
_cell_measurement_theta_min      4
_cell_volume                     1006.3(2)
_computing_molecular_graphics    'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.5 (Dolomanov et al., 2009)'
_computing_structure_refinement  'SHELXL 2014/6 (Sheldrick, 2015)'
_computing_structure_solution    'SHELXT 2014/4 (Sheldrick, 2014)'
_diffrn_ambient_temperature      313.55
_diffrn_detector_area_resol_mean 10
_diffrn_measured_fraction_theta_full 0.979
_diffrn_measured_fraction_theta_max 0.973
_diffrn_measurement_device_type  RAPID
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54187
_diffrn_reflns_av_R_equivalents  0.0689
_diffrn_reflns_av_unetI/netI     0.0723
_diffrn_reflns_Laue_measured_fraction_full 0.979
_diffrn_reflns_Laue_measured_fraction_max 0.973
_diffrn_reflns_limit_h_max       7
_diffrn_reflns_limit_h_min       -7
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_l_max       20
_diffrn_reflns_limit_l_min       -20
_diffrn_reflns_number            11191
_diffrn_reflns_point_group_measured_fraction_full 0.979
_diffrn_reflns_point_group_measured_fraction_max 0.973
_diffrn_reflns_theta_full        67.687
_diffrn_reflns_theta_max         68.167
_diffrn_reflns_theta_min         4.463
_exptl_absorpt_coefficient_mu    0.629
_exptl_absorpt_correction_T_max  1
_exptl_absorpt_correction_T_min  0.6656
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   ABSCOR(Rigaku,1995)
_exptl_crystal_colour            'clear yellowish yellow'
_exptl_crystal_colour_lustre     clear
_exptl_crystal_colour_modifier   yellowish
_exptl_crystal_colour_primary    yellow
_exptl_crystal_density_diffrn    1.170
_exptl_crystal_description       prism
_exptl_crystal_F_000             380
_exptl_crystal_size_max          1
_exptl_crystal_size_mid          0.6
_exptl_crystal_size_min          0.3
_refine_diff_density_max         0.136
_refine_diff_density_min         -0.234
_refine_diff_density_rms         0.051
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.094
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     273
_refine_ls_number_reflns         3589
_refine_ls_number_restraints     72
_refine_ls_restrained_S_all      1.101
_refine_ls_R_factor_all          0.1342
_refine_ls_R_factor_gt           0.0823
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0958P)²+0.0184P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1982
_refine_ls_wR_factor_ref         0.2249
_reflns_Friedel_coverage         0.000
_reflns_number_gt                1818
_reflns_number_total             3589
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d3sc04796b3.cif
_cod_data_source_block           40point4degC
_cod_depositor_comments
'Adding full bibliography for 1570536--1570543.cif.'
_cod_database_code               1570540
_shelxl_version_number           2014/6
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_shelx_estimated_absorpt_t_max   1
_shelx_estimated_absorpt_t_min   0.6656
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups
 At 1.5 times of:
  All C(H,H,H) groups, All O(H) groups
2. Uiso/Uaniso restraints and constraints
C2 \\sim C00I \\sim C1 \\sim C00R: within 2A with sigma of 0.04 and sigma for
terminal atoms of 0.08 within 2A
C00I \\sim C00O \\sim C00P \\sim C00Q: within 2A with sigma of 0.04 and sigma
for terminal atoms of 0.08 within 2A
3. Rigid body (RIGU) restrains
 C2, C00I, C1, C00R
 with sigma for 1-2 distances of 0.004 and sigma for 1-3 distances of 0.004
 C00O, C00P, C00I, C00Q
 with sigma for 1-2 distances of 0.004 and sigma for 1-3 distances of 0.004
4. Others
 Sof(C1)=Sof(H1A)=Sof(H1B)=Sof(H1C)=Sof(C2)=Sof(H2A)=Sof(H2B)=Sof(H2C)=
 Sof(C00R)=Sof(H00Y)=Sof(H)=Sof(HA)=1-FVAR(1)
 Sof(C00O)=Sof(H00P)=Sof(H00Q)=Sof(H00R)=Sof(C00P)=Sof(H00S)=Sof(H00T)=
 Sof(H00U)=Sof(C00Q)=Sof(H00V)=Sof(H00W)=Sof(H00X)=FVAR(1)
5.a Aromatic/amide H refined with riding coordinates:
 C009(H009), C00B(H00B), C00D(H00D), C00E(H00E), C00H(H00H), C00J(H00J),
 C00K(H00K)
5.b Idealised Me refined as rotating group:
 C00L(H00A,H00C,H00F), C00M(H00G,H00I,H00L), C00N(H00M,H00N,H00O), C00O(H00P,
 H00Q,H00R), C00P(H00S,H00T,H00U), C00Q(H00V,H00W,H00X), C1(H1A,H1B,H1C),
 C2(H2A,H2B,H2C), C00R(H00Y,H,HA)
5.c Idealised tetrahedral OH refined as rotating group:
 O001(H001)
;
_olex2_submission_special_instructions 'No special instructions were received'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
O001 O 0.3537(4) 0.39921(19) 0.31666(12) 0.0854(7) Uani 1 1 d . . . . .
H001 H 0.2744 0.4425 0.3447 0.128 Uiso 1 1 calc R U . . .
N002 N 0.1902(4) 0.6067(2) 0.38146(15) 0.0766(7) Uani 1 1 d . . . . .
N3 N 0.1550(6) 0.9861(3) 0.60102(18) 0.0939(9) Uani 1 1 d . . . . .
O004 O 0.3559(5) 1.0282(3) 0.59730(16) 0.1306(11) Uani 1 1 d . . . . .
C005 C 0.4629(5) 0.4752(3) 0.26674(17) 0.0674(8) Uani 1 1 d . . . . .
O5 O 0.0390(5) 1.0437(3) 0.64731(16) 0.1293(10) Uani 1 1 d . . . . .
C007 C 0.4431(5) 0.6100(3) 0.27456(16) 0.0673(8) Uani 1 1 d . . . . .
C008 C 0.6891(5) 0.6373(3) 0.16629(17) 0.0688(8) Uani 1 1 d . . . . .
C009 C 0.3062(5) 0.6707(3) 0.33374(18) 0.0749(8) Uani 1 1 d . . . . .
H009 H 0.3024 0.7613 0.3373 0.090 Uiso 1 1 calc R U . . .
C00A C 0.5959(5) 0.4185(3) 0.20973(17) 0.0671(8) Uani 1 1 d . . . . .
C00B C 0.7039(5) 0.5020(3) 0.16119(16) 0.0704(8) Uani 1 1 d . . . . .
H00B H 0.7927 0.4657 0.1224 0.084 Uiso 1 1 calc R U . . .
C00C C 0.0709(6) 0.6760(3) 0.44017(17) 0.0697(8) Uani 1 1 d . . . . .
C00D C 0.1705(5) 0.7988(3) 0.48929(18) 0.0732(8) Uani 1 1 d . . . . .
H00D H 0.3186 0.8406 0.4836 0.088 Uiso 1 1 calc R U . . .
C00E C 0.5586(5) 0.6878(3) 0.22428(17) 0.0716(8) Uani 1 1 d . . . . .
H00E H 0.5467 0.7775 0.2303 0.086 Uiso 1 1 calc R U . . .
C00F C 0.0444(6) 0.8575(3) 0.54683(18) 0.0739(9) Uani 1 1 d . . . . .
C00G C 0.6228(5) 0.2716(3) 0.20077(18) 0.0753(9) Uani 1 1 d . . . . .
C00H C -0.1492(6) 0.6170(3) 0.45033(19) 0.0809(9) Uani 1 1 d . . . . .
H00H H -0.2154 0.5336 0.4180 0.097 Uiso 1 1 calc R U . . .
C00I C 0.8160(6) 0.7200(3) 0.11013(18) 0.0760(9) Uani 1 1 d . U . . .
C00J C -0.1753(6) 0.8018(4) 0.55674(19) 0.0829(9) Uani 1 1 d . . . . .
H00J H -0.2567 0.8450 0.5955 0.099 Uiso 1 1 calc R U . . .
C00K C -0.2721(6) 0.6789(4) 0.5070(2) 0.0875(10) Uani 1 1 d . . . . .
H00K H -0.4211 0.6382 0.5121 0.105 Uiso 1 1 calc R U . . .
C00L C 0.3912(6) 0.1747(3) 0.1793(2) 0.1009(11) Uani 1 1 d . . . . .
H00A H 0.2938 0.1932 0.2220 0.151 Uiso 1 1 calc R U . . .
H00C H 0.4105 0.0833 0.1733 0.151 Uiso 1 1 calc R U . . .
H00F H 0.3247 0.1871 0.1293 0.151 Uiso 1 1 calc R U . . .
C00M C 0.7306(6) 0.2513(3) 0.2805(2) 0.1001(11) Uani 1 1 d . . . . .
H00G H 0.8756 0.3116 0.2936 0.150 Uiso 1 1 calc R U . . .
H00I H 0.7494 0.1598 0.2742 0.150 Uiso 1 1 calc R U . . .
H00L H 0.6340 0.2699 0.3234 0.150 Uiso 1 1 calc R U . . .
C00N C 0.7775(6) 0.2347(3) 0.1337(2) 0.1067(12) Uani 1 1 d . . . . .
H00M H 0.7118 0.2430 0.0826 0.160 Uiso 1 1 calc R U . . .
H00N H 0.7945 0.1434 0.1308 0.160 Uiso 1 1 calc R U . . .
H00O H 0.9233 0.2945 0.1458 0.160 Uiso 1 1 calc R U . . .
C00O C 0.7434(11) 0.6491(5) 0.0215(3) 0.113(2) Uani 0.767(6) 1 d . U P A 1
H00P H 0.5846 0.6444 0.0105 0.169 Uiso 0.767(6) 1 calc R U P A 1
H00Q H 0.7723 0.5594 0.0126 0.169 Uiso 0.767(6) 1 calc R U P A 1
H00R H 0.8280 0.6989 -0.0141 0.169 Uiso 0.767(6) 1 calc R U P A 1
C00P C 0.7675(11) 0.8607(5) 0.1215(4) 0.126(2) Uani 0.767(6) 1 d . U P A 1
H00S H 0.8515 0.9091 0.0851 0.188 Uiso 0.767(6) 1 calc R U P A 1
H00T H 0.8118 0.9076 0.1765 0.188 Uiso 0.767(6) 1 calc R U P A 1
H00U H 0.6085 0.8546 0.1100 0.188 Uiso 0.767(6) 1 calc R U P A 1
C00Q C 1.0693(8) 0.7319(7) 0.1257(4) 0.128(2) Uani 0.767(6) 1 d . U P A 1
H00V H 1.1485 0.7815 0.0890 0.192 Uiso 0.767(6) 1 calc R U P A 1
H00W H 1.1026 0.6433 0.1174 0.192 Uiso 0.767(6) 1 calc R U P A 1
H00X H 1.1167 0.7783 0.1807 0.192 Uiso 0.767(6) 1 calc R U P A 1
C1 C 0.960(4) 0.6472(18) 0.0535(13) 0.120(6) Uani 0.233(6) 1 d . U P A 2
H1A H 0.8729 0.5599 0.0276 0.180 Uiso 0.233(6) 1 calc R U P A 2
H1B H 1.0905 0.6367 0.0838 0.180 Uiso 0.233(6) 1 calc R U P A 2
H1C H 1.0069 0.6986 0.0130 0.180 Uiso 0.233(6) 1 calc R U P A 2
C2 C 0.645(3) 0.777(2) 0.0632(12) 0.107(5) Uani 0.233(6) 1 d . U P A 2
H2A H 0.5681 0.8306 0.1011 0.160 Uiso 0.233(6) 1 calc R U P A 2
H2B H 0.5373 0.7035 0.0304 0.160 Uiso 0.233(6) 1 calc R U P A 2
H2C H 0.7249 0.8317 0.0290 0.160 Uiso 0.233(6) 1 calc R U P A 2
C00R C 0.989(3) 0.8503(16) 0.1660(9) 0.099(5) Uani 0.233(6) 1 d . U P A 2
H00Y H 1.0839 0.8976 0.1316 0.148 Uiso 0.233(6) 1 calc R U P A 2
H H 1.0825 0.8201 0.2031 0.148 Uiso 0.233(6) 1 calc R U P A 2
HA H 0.9040 0.9096 0.1959 0.148 Uiso 0.233(6) 1 calc R U P A 2
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0492 0.0322 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
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
C005 O001 H001 109.5 . . ?
C009 N002 C00C 119.7(3) . . ?
O004 N3 O5 123.7(4) . . ?
O004 N3 C00F 118.5(3) . . ?
O5 N3 C00F 117.8(3) . . ?
O001 C005 C007 119.5(3) . . ?
O001 C005 C00A 119.4(3) . . ?
C00A C005 C007 121.1(3) . . ?
C005 C007 C009 121.9(3) . . ?
C00E C007 C005 119.1(3) . . ?
C00E C007 C009 119.0(3) . . ?
C00B C008 C00I 120.4(3) . . ?
C00E C008 C00B 116.1(3) . . ?
C00E C008 C00I 123.5(3) . . ?
N002 C009 C007 123.6(3) . . ?
N002 C009 H009 118.2 . . ?
C007 C009 H009 118.2 . . ?
C005 C00A C00G 122.1(3) . . ?
C00B C00A C005 116.4(3) . . ?
C00B C00A C00G 121.5(3) . . ?
C008 C00B H00B 117.6 . . ?
C00A C00B C008 124.8(3) . . ?
C00A C00B H00B 117.6 . . ?
C00D C00C N002 121.8(3) . . ?
C00H C00C N002 118.8(3) . . ?
C00H C00C C00D 119.3(3) . . ?
C00C C00D H00D 120.9 . . ?
C00F C00D C00C 118.1(3) . . ?
C00F C00D H00D 120.9 . . ?
C007 C00E H00E 118.8 . . ?
C008 C00E C007 122.5(3) . . ?
C008 C00E H00E 118.8 . . ?
C00D C00F N3 117.8(3) . . ?
C00J C00F N3 118.9(3) . . ?
C00J C00F C00D 123.4(3) . . ?
C00L C00G C00A 110.3(2) . . ?
C00L C00G C00M 109.6(2) . . ?
C00M C00G C00A 109.9(2) . . ?
C00N C00G C00A 111.5(2) . . ?
C00N C00G C00L 108.1(3) . . ?
C00N C00G C00M 107.4(3) . . ?
C00C C00H H00H 119.3 . . ?
C00K C00H C00C 121.3(3) . . ?
C00K C00H H00H 119.3 . . ?
C008 C00I C00O 109.3(3) . . ?
C008 C00I C2 109.0(6) . . ?
C008 C00I C00R 108.4(5) . . ?
C00P C00I C008 112.5(3) . . ?
C00P C00I C00O 107.7(4) . . ?
C00P C00I C00Q 108.7(4) . . ?
C00Q C00I C008 109.7(3) . . ?
C00Q C00I C00O 108.9(4) . . ?
C1 C00I C008 115.0(7) . . ?
C1 C00I C2 111.5(11) . . ?
C1 C00I C00R 106.1(11) . . ?
C2 C00I C00R 106.5(10) . . ?
C00F C00J H00J 121.2 . . ?
C00F C00J C00K 117.6(3) . . ?
C00K C00J H00J 121.2 . . ?
C00H C00K C00J 120.2(3) . . ?
C00H C00K H00K 119.9 . . ?
C00J C00K H00K 119.9 . . ?
C00G C00L H00A 109.5 . . ?
C00G C00L H00C 109.5 . . ?
C00G C00L H00F 109.5 . . ?
H00A C00L H00C 109.5 . . ?
H00A C00L H00F 109.5 . . ?
H00C C00L H00F 109.5 . . ?
C00G C00M H00G 109.5 . . ?
C00G C00M H00I 109.5 . . ?
C00G C00M H00L 109.5 . . ?
H00G C00M H00I 109.5 . . ?
H00G C00M H00L 109.5 . . ?
H00I C00M H00L 109.5 . . ?
C00G C00N H00M 109.5 . . ?
C00G C00N H00N 109.5 . . ?
C00G C00N H00O 109.5 . . ?
H00M C00N H00N 109.5 . . ?
H00M C00N H00O 109.5 . . ?
H00N C00N H00O 109.5 . . ?
C00I C00O H00P 109.5 . . ?
C00I C00O H00Q 109.5 . . ?
C00I C00O H00R 109.5 . . ?
H00P C00O H00Q 109.5 . . ?
H00P C00O H00R 109.5 . . ?
H00Q C00O H00R 109.5 . . ?
C00I C00P H00S 109.5 . . ?
C00I C00P H00T 109.5 . . ?
C00I C00P H00U 109.5 . . ?
H00S C00P H00T 109.5 . . ?
H00S C00P H00U 109.5 . . ?
H00T C00P H00U 109.5 . . ?
C00I C00Q H00V 109.5 . . ?
C00I C00Q H00W 109.5 . . ?
C00I C00Q H00X 109.5 . . ?
H00V C00Q H00W 109.5 . . ?
H00V C00Q H00X 109.5 . . ?
H00W C00Q H00X 109.5 . . ?
C00I C1 H1A 109.5 . . ?
C00I C1 H1B 109.5 . . ?
C00I C1 H1C 109.5 . . ?
H1A C1 H1B 109.5 . . ?
H1A C1 H1C 109.5 . . ?
H1B C1 H1C 109.5 . . ?
C00I C2 H2A 109.5 . . ?
C00I C2 H2B 109.5 . . ?
C00I C2 H2C 109.5 . . ?
H2A C2 H2B 109.5 . . ?
H2A C2 H2C 109.5 . . ?
H2B C2 H2C 109.5 . . ?
C00I C00R H00Y 109.5 . . ?
C00I C00R H 109.5 . . ?
C00I C00R HA 109.5 . . ?
H00Y C00R H 109.5 . . ?
H00Y C00R HA 109.5 . . ?
H C00R HA 109.5 . . ?
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
O001 H001 0.8200 . ?
O001 C005 1.359(3) . ?
N002 C009 1.279(3) . ?
N002 C00C 1.412(3) . ?
N3 O004 1.214(3) . ?
N3 O5 1.216(3) . ?
N3 C00F 1.476(4) . ?
C005 C007 1.401(4) . ?
C005 C00A 1.392(4) . ?
C007 C009 1.447(4) . ?
C007 C00E 1.390(3) . ?
C008 C00B 1.403(3) . ?
C008 C00E 1.367(3) . ?
C008 C00I 1.522(4) . ?
C009 H009 0.9300 . ?
C00A C00B 1.387(3) . ?
C00A C00G 1.537(3) . ?
C00B H00B 0.9300 . ?
C00C C00D 1.383(4) . ?
C00C C00H 1.380(4) . ?
C00D H00D 0.9300 . ?
C00D C00F 1.377(4) . ?
C00E H00E 0.9300 . ?
C00F C00J 1.369(4) . ?
C00G C00L 1.536(4) . ?
C00G C00M 1.536(4) . ?
C00G C00N 1.532(4) . ?
C00H H00H 0.9300 . ?
C00H C00K 1.369(4) . ?
C00I C00O 1.535(5) . ?
C00I C00P 1.515(5) . ?
C00I C00Q 1.519(5) . ?
C00I C1 1.507(16) . ?
C00I C2 1.543(16) . ?
C00I C00R 1.635(15) . ?
C00J H00J 0.9300 . ?
C00J C00K 1.383(4) . ?
C00K H00K 0.9300 . ?
C00L H00A 0.9600 . ?
C00L H00C 0.9600 . ?
C00L H00F 0.9600 . ?
C00M H00G 0.9600 . ?
C00M H00I 0.9600 . ?
C00M H00L 0.9600 . ?
C00N H00M 0.9600 . ?
C00N H00N 0.9600 . ?
C00N H00O 0.9600 . ?
C00O H00P 0.9600 . ?
C00O H00Q 0.9600 . ?
C00O H00R 0.9600 . ?
C00P H00S 0.9600 . ?
C00P H00T 0.9600 . ?
C00P H00U 0.9600 . ?
C00Q H00V 0.9600 . ?
C00Q H00W 0.9600 . ?
C00Q H00X 0.9600 . ?
C1 H1A 0.9600 . ?
C1 H1B 0.9600 . ?
C1 H1C 0.9600 . ?
C2 H2A 0.9600 . ?
C2 H2B 0.9600 . ?
C2 H2C 0.9600 . ?
C00R H00Y 0.9600 . ?
C00R H 0.9600 . ?
C00R HA 0.9600 . ?
