Making hybrid [n]-rotaxanes as supramolecular arrays of molecular electron spin qubits
Antonio Fernandez; Jesus Ferrando-Soria; Eufemio Moreno Pineda; Floriana Tuna; Inigo J. Vitorica-Yrezabal; Christiane Knappke; Jakub Ujma; Christopher A. Muryn; Grigore A. Timco; Perdita E. Barran; Arzhang Ardavan; Richard E.P. Winpenny; Nature Communications 7 (2016) 10240–; doi:10.1038/ncomms10240

data_1548193
_publ_section_title
;
 Making hybrid [n]-rotaxanes as supramolecular arrays of molecular
 electron spin qubits
;
_journal_name_full               'Nature Communications'
_journal_page_first              10240
_journal_paper_doi               10.1038/ncomms10240
_journal_volume                  7
_journal_year                    2016
_chemical_formula_moiety
'C96 H129 Co1 Fe2 N6 O13, 3(C80 H144 Cr7 F8 Ni O32)'
_chemical_formula_sum            'C336 H561 Co Cr21 F24 Fe2 N6 Ni3 O109'
_chemical_formula_weight         8323.63
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_cell_angle_alpha                73.3116(13)
_cell_angle_beta                 86.8220(14)
_cell_angle_gamma                78.9831(14)
_cell_formula_units_Z            2
_cell_length_a                   25.5047(5)
_cell_length_b                   31.7138(4)
_cell_length_c                   31.7614(5)
_cell_measurement_reflns_used    33032
_cell_measurement_temperature    100
_cell_measurement_theta_max      25.5280
_cell_measurement_theta_min      1.7910
_cell_volume                     24154.7(7)
_computing_cell_refinement
'CrysAlisPro, Agilent Technologies, Version 1.171.37.33 (release 27-03-2014 CrysAlis171 .NET) (compiled Mar 27 2014,17:12:48)'
_computing_data_collection
'CrysAlisPro, Agilent Technologies, Version 1.171.37.33 (release 27-03-2014 CrysAlis171 .NET) (compiled Mar 27 2014,17:12:48)'
_computing_data_reduction
'CrysAlisPro, Agilent Technologies, Version 1.171.37.33 (release 27-03-2014 CrysAlis171 .NET) (compiled Mar 27 2014,17:12:48)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'XL (Sheldrick, 2008)'
_computing_structure_solution    'XS (Sheldrick, 2008)'
_diffrn_ambient_temperature      100.0
_diffrn_detector                 'CCD plate'
_diffrn_measured_fraction_theta_full 0.980
_diffrn_measured_fraction_theta_max 0.972
_diffrn_measurement_details
;
  1 omega  -60.00  115.00   1.0000    3.0000
omega____ theta____ kappa____ phi______ frames
    -       30.0000    0.0000    0.0000 175

  2 omega  -60.00   60.00   1.0000    3.0000
omega____ theta____ kappa____ phi______ frames
    -       30.0000  -50.0000    0.0000 120

  3 omega  -60.00   60.00   1.0000    3.0000
omega____ theta____ kappa____ phi______ frames
    -       30.0000  -50.0000  120.0000 120

  4 omega  -60.00   60.00   1.0000    3.0000
omega____ theta____ kappa____ phi______ frames
    -       30.0000  -50.0000  240.0000 120
;
_diffrn_measurement_device       'abstract diffractometer'
_diffrn_measurement_device_type
'dtrek-CrysAlisPro-abstract goniometer imported rigaku-d*trek images'
_diffrn_measurement_method       '\w scans'
_diffrn_orient_matrix_UB_11      -0.0022084000
_diffrn_orient_matrix_UB_12      0.0073811000
_diffrn_orient_matrix_UB_13      -0.0225621000
_diffrn_orient_matrix_UB_21      -0.0274015000
_diffrn_orient_matrix_UB_22      0.0026755000
_diffrn_orient_matrix_UB_23      0.0018023000
_diffrn_orient_matrix_UB_31      -0.0012288000
_diffrn_orient_matrix_UB_32      0.0216907000
_diffrn_orient_matrix_UB_33      0.0006596000
_diffrn_radiation_monochromator  synchrotron
_diffrn_radiation_probe          x-ray
_diffrn_radiation_wavelength     0.6889
_diffrn_reflns_av_R_equivalents  0.0635
_diffrn_reflns_av_unetI/netI     0.0926
_diffrn_reflns_Laue_measured_fraction_full 0.980
_diffrn_reflns_Laue_measured_fraction_max 0.972
_diffrn_reflns_limit_h_max       31
_diffrn_reflns_limit_h_min       -31
_diffrn_reflns_limit_k_max       38
_diffrn_reflns_limit_k_min       -26
_diffrn_reflns_limit_l_max       39
_diffrn_reflns_limit_l_min       -39
_diffrn_reflns_number            222171
_diffrn_reflns_point_group_measured_fraction_full 0.980
_diffrn_reflns_point_group_measured_fraction_max 0.972
_diffrn_reflns_theta_full        24.415
_diffrn_reflns_theta_max         25.503
_diffrn_reflns_theta_min         1.519
_diffrn_source                   synchrotron
_exptl_absorpt_coefficient_mu    0.690
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.55395
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
'CrysAlisPro, Agilent Technologies, Version 1.171.37.33 (release 27-03-2014 CrysAlis171 .NET) (compiled Mar 27 2014,17:12:48) Empirical absorption correction using spherical harmonics, implemented in SCALE3 ABSPACK scaling algorithm.'
_exptl_crystal_colour            'clear green'
_exptl_crystal_colour_lustre     clear
_exptl_crystal_colour_primary    green
_exptl_crystal_density_diffrn    1.144
_exptl_crystal_description
;
;
_exptl_crystal_F_000             8748
_exptl_crystal_size_max          0.06
_exptl_crystal_size_mid          0.05
_exptl_crystal_size_min          0.04
_refine_diff_density_max         0.804
_refine_diff_density_min         -0.706
_refine_diff_density_rms         0.067
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.995
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     4693
_refine_ls_number_reflns         96021
_refine_ls_number_restraints     921
_refine_ls_restrained_S_all      8.652
_refine_ls_R_factor_all          0.1133
_refine_ls_R_factor_gt           0.0635
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.0836P)^2^] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1597
_refine_ls_wR_factor_ref         0.1999
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                54954
_reflns_number_total             96021
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            ncomms10240-s3.cif
_cod_data_source_block           3-Rotaxane
_cod_database_code               1548193
_reflns_odcompleteness_completeness 82.48
_reflns_odcompleteness_iscentric 1
_reflns_odcompleteness_theta     32.16
_olex2_refinement_description
;
1. Shared sites
{Fe1, Co1A}
{Fe2, Co2A}
{Co3, Fe3}
{Ni8B, Cr8B}
{Ni1B, Cr1B}
{Cr2B, Ni2B}
{Cr3B, Ni3B}
{Ni4B, Cr4B}
{Cr5B, Ni5B}
{Ni6B, Cr6B}
{Cr7B, Ni7B}
{H91A, H87A}
{Ni7C, Cr7C}
{Ni8C, Cr8C}
{Ni1C, Cr1C}
{Ni2C, Cr2C}
{Ni3C, Cr3C}
{Cr4C, Ni4C}
{Ni5C, Cr5C}
{Ni6C, Cr6C}
{Cr8A, Ni8A}
{Ni1A, Cr1A}
{Ni2A, Cr2A}
{Cr3A, Ni3A}
{Ni4A, Cr4A}
{Ni5A, Cr5A}
{Cr6A, Ni6A}
{Ni7A, Cr7A}
2. Others
 Fixed Sof: Fe1(0.6667) Fe2(0.6667) Fe3(0.6667) Cr8B(0.875) Cr1B(0.875)
 Cr2B(0.875) Cr3B(0.875) Cr4B(0.875) Cr5B(0.875) Cr6B(0.875) Cr7B(0.875)
 Cr7C(0.875) Cr8C(0.875) Cr1C(0.875) Cr2C(0.875) Cr3C(0.875) Cr4C(0.875)
 Cr5C(0.875) Cr6C(0.875) Cr8A(0.875) Cr1A(0.875) Cr2A(0.875) Cr3A(0.875)
 Cr4A(0.875) Cr5A(0.875) Cr6A(0.875) Cr7A(0.875) Co1A(0.3333) Co2A(0.3333)
 Co3(0.3333) Ni1A(0.125) Ni2A(0.125) Ni3A(0.125) Ni4A(0.125) Ni5A(0.125)
 Ni6A(0.125) Ni7A(0.125) Ni8A(0.125) Ni1B(0.125) Ni2B(0.125) Ni3B(0.125)
 Ni4B(0.125) Ni5B(0.125) Ni6B(0.125) Ni7B(0.125) Ni8B(0.125) Ni1C(0.125)
 Ni2C(0.125) Ni3C(0.125) Ni4C(0.125) Ni5C(0.125) Ni6C(0.125) Ni7C(0.125)
 Ni8C(0.125)
 Fixed Uiso: H2A(0.061) H2B(0.061) H4A(0.087) H4B(0.087) H6A(0.058) H6B(0.058)
 H25A(0.361) H25B(0.361) H25C(0.361) H25D(0.363) H25E(0.363) H25F(0.363)
 H25G(0.3) H25H(0.3) H25I(0.3) H26A(0.122) H26B(0.122) H26C(0.122) H26D(0.129)
 H26E(0.129) H26F(0.129) H27A(0.13) H27B(0.13) H27C(0.13) H27D(0.176)
 H27E(0.176) H27F(0.176) H27G(0.172) H27H(0.172) H27I(0.172) H27J(0.15)
 H27K(0.15) H27L(0.15) H27M(0.354) H27N(0.354) H27O(0.354) H27P(0.302)
 H27Q(0.302) H27R(0.302) H28A(0.204) H28B(0.204) H28C(0.204) H289(0.071)
 H290(0.07) H292(0.065) H293(0.068) H295(0.065) H296(0.063) H298(0.069)
 H299(0.073) H30A(0.062) H30B(0.062) H30C(0.065) H30D(0.065) H30E(0.072)
 H30F(0.072) H30G(0.086) H30H(0.086) H30I(0.105) H30J(0.105) H306(0.225)
 H307(0.279) H308(0.241) H309(0.238) H310(0.177) H317(0.079) H318(0.077)
 H320(0.077) H321(0.083) H324(0.066) H323(0.073) H327(0.092) H326(0.085)
 H33A(0.056) H33B(0.056) H33C(0.055) H33D(0.055) H33E(0.073) H33F(0.073)
 H33G(0.071) H33H(0.071) H33I(0.099) H33J(0.099) H338(0.19) H339(0.231)
 H340(0.198) H341(0.191) H342(0.161) H343(0.069) H344(0.071) H346(0.103)
 H347(0.097) H35A(0.088) H35B(0.088) H35C(0.074) H35D(0.074) H35E(0.074)
 H35F(0.074) H26G(0.171) H26H(0.171) H26I(0.171) H26J(0.171) H26K(0.171)
 H26L(0.171) H26M(0.171) H26N(0.171) H26O(0.171) H28D(0.178) H28E(0.178)
 H28F(0.178) H28G(0.182) H28H(0.182) H28I(0.182) H28J(0.203) H28K(0.203)
 H28L(0.203) H328(0.072) H329(0.069) H330(0.068) H331(0.067) H354(0.08)
 H355(0.083) H356(0.111) H357(0.104) H36A(0.123) H36B(0.123) H36C(0.094)
 H36D(0.094) H36E(0.163) H36F(0.163) H364(0.2) H365(0.2) H366(0.2) H367(0.2)
 H368(0.2) H26P(0.171) H26Q(0.171) H26R(0.171) H26S(0.171) H26T(0.171)
 H26U(0.171) H26V(0.171) H26W(0.171) H26X(0.171) H28M(0.199) H28N(0.199)
 H28O(0.199) H28P(0.12) H28Q(0.12) H28R(0.12) H28S(0.157) H28T(0.157)
 H28U(0.157) H349(0.081) H350(0.08) H352(0.084) H353(0.084) H36G(0.123)
 H36H(0.123) H37A(0.126) H37B(0.126) H37C(0.163) H37D(0.163) H373(0.2)
 H374(0.2) H375(0.2) H376(0.2) H377(0.2) H94A(0.186) H94B(0.186) H94C(0.186)
 H95A(0.23) H95B(0.23) H95C(0.23) H96A(0.186) H96B(0.186) H96C(0.186)
 H99A(0.198) H99B(0.198) H99C(0.198) H10A(0.149) H10B(0.149) H10C(0.149)
 H10D(0.147) H10E(0.147) H10F(0.147) H10G(0.158) H10H(0.158) H10I(0.158)
 H10J(0.239) H10K(0.239) H10L(0.239) H10M(0.206) H10N(0.206) H10O(0.206)
 H10P(0.221) H10Q(0.221) H10R(0.221) H11A(0.19) H11B(0.19) H11C(0.19)
 H11D(0.252) H11E(0.252) H11F(0.252) H11G(0.16) H11H(0.16) H11I(0.16)
 H11J(0.19) H11K(0.19) H11L(0.19) H11M(0.234) H11N(0.234) H11O(0.234)
 H11P(0.185) H11Q(0.185) H11R(0.185) H12A(0.253) H12B(0.253) H12C(0.253)
 H12D(0.217) H12E(0.217) H12F(0.217) H12G(0.157) H12H(0.157) H12I(0.157)
 H12J(0.228) H12K(0.228) H12L(0.228) H12M(0.24) H12N(0.24) H12O(0.24)
 H12P(0.262) H12Q(0.262) H12R(0.262) H13A(0.223) H13B(0.223) H13C(0.223)
 H13D(0.195) H13E(0.195) H13F(0.195) H14A(0.197) H14B(0.197) H14C(0.197)
 H14D(0.162) H14E(0.162) H14F(0.162) H14G(0.207) H14H(0.207) H14I(0.207)
 H14J(0.143) H14K(0.143) H14L(0.143) H14M(0.132) H14N(0.132) H14O(0.132)
 H14P(0.143) H14Q(0.143) H14R(0.143) H15A(0.211) H15B(0.211) H15C(0.211)
 H15D(0.285) H15E(0.285) H15F(0.285) H15G(0.195) H15H(0.195) H15I(0.195)
 H15J(0.152) H15K(0.152) H15L(0.152) H15M(0.166) H15N(0.166) H15O(0.166)
 H15P(0.16) H15Q(0.16) H15R(0.16) H16A(0.213) H16B(0.213) H16C(0.213)
 H16D(0.115) H16E(0.115) H16F(0.115) H16G(0.206) H16H(0.206) H16I(0.206)
 H16J(0.132) H16K(0.132) H16L(0.132) H16M(0.145) H16N(0.145) H16O(0.145)
 H16P(0.144) H16Q(0.144) H16R(0.144) H86A(0.186) H86B(0.186) H86C(0.186)
 H87A(0.168) H87B(0.168) H87C(0.168) H88A(0.194) H88B(0.194) H88C(0.194)
 H13G(0.169) H13H(0.169) H13I(0.169) H13J(0.155) H13K(0.155) H13L(0.155)
 H13M(0.152) H13N(0.152) H13O(0.152) H89A(0.147) H89B(0.147) H89C(0.147)
 H90A(0.172) H90B(0.172) H90C(0.172) H91A(0.177) H91B(0.177) H91C(0.177)
 H13P(0.199) H13Q(0.199) H13R(0.199) H13S(0.15) H13T(0.15) H13U(0.15)
 H13V(0.192) H13W(0.192) H13X(0.192) H17A(0.272) H17B(0.272) H17C(0.272)
 H17D(0.169) H17E(0.169) H17F(0.169) H17G(0.256) H17H(0.256) H17I(0.256)
 H17J(0.319) H17K(0.319) H17L(0.319) H17M(0.318) H17N(0.318) H17O(0.318)
 H17P(0.229) H17Q(0.229) H17R(0.229) H18A(0.203) H18B(0.203) H18C(0.203)
 H18D(0.204) H18E(0.204) H18F(0.204) H18G(0.226) H18H(0.226) H18I(0.226)
 H18J(0.242) H18K(0.242) H18L(0.242) H18M(0.341) H18N(0.341) H18O(0.341)
 H18P(0.244) H18Q(0.244) H18R(0.244) H19A(0.262) H19B(0.262) H19C(0.262)
 H19D(0.225) H19E(0.225) H19F(0.225) H19G(0.301) H19H(0.301) H19I(0.301)
 H19J(0.176) H19K(0.176) H19L(0.176) H19M(0.195) H19N(0.195) H19O(0.195)
 H19P(0.169) H19Q(0.169) H19R(0.169) H20A(0.258) H20B(0.258) H20C(0.258)
 H20D(0.194) H20E(0.194) H20F(0.194) H20G(0.209) H20H(0.209) H20I(0.209)
 H20J(0.193) H20K(0.193) H20L(0.193) H20M(0.252) H20N(0.252) H20O(0.252)
 H20P(0.248) H20Q(0.248) H20R(0.248) H21A(0.183) H21B(0.183) H21C(0.183)
 H21D(0.178) H21E(0.178) H21F(0.178) H21G(0.242) H21H(0.242) H21I(0.242)
 H22A(0.233) H22B(0.233) H22C(0.233) H22D(0.302) H22E(0.302) H22F(0.302)
 H22G(0.165) H22H(0.165) H22I(0.165) H23A(0.25) H23B(0.25) H23C(0.25)
 H23D(0.28) H23E(0.28) H23F(0.28) H23G(0.255) H23H(0.255) H23I(0.255)
 H23J(0.147) H23K(0.147) H23L(0.147) H23M(0.192) H23N(0.192) H23O(0.192)
 H23P(0.214) H23Q(0.214) H23R(0.214) H24A(0.321) H24B(0.321) H24C(0.321)
 H24D(0.279) H24E(0.279) H24F(0.279) H24G(0.239) H24H(0.239) H24I(0.239)
 H24J(0.253) H24K(0.253) H24L(0.253) H24M(0.308) H24N(0.308) H24O(0.308)
 H24P(0.221) H24Q(0.221) H24R(0.221) H25J(0.311) H25K(0.311) H25L(0.311)
 H25M(0.259) H25N(0.259) H25O(0.259) H25P(0.275) H25Q(0.275) H25R(0.275)
 H22J(0.157) H22K(0.157) H22L(0.157) H22M(0.15) H22N(0.15) H22O(0.15)
 H22P(0.191) H22Q(0.191) H22R(0.191) H21J(0.157) H21K(0.157) H21L(0.157)
 H21M(0.177) H21N(0.177) H21O(0.177) H21P(0.139) H21Q(0.139) H21R(0.139)
 H3A(0.208) H3B(0.208) H3C(0.208) H4C(0.268) H4D(0.268) H4E(0.268) H5A(0.208)
 H5B(0.208) H5C(0.208) H8A(0.248) H8B(0.248) H8C(0.248) H9A(0.255) H9B(0.255)
 H9C(0.255) H10S(0.332) H10T(0.332) H10U(0.332) H13Y(0.248) H(0.248) HA(0.248)
 H14S(0.23) H14T(0.23) H14U(0.23) H15S(0.164) H15T(0.164) H15U(0.164)
 H18S(0.206) H18T(0.206) H18U(0.206) H19S(0.284) H19T(0.284) H19U(0.284)
 H20S(0.352) H20T(0.352) H20U(0.352) H23S(0.233) H23T(0.233) H23U(0.233)
 H24S(0.292) H24T(0.292) H24U(0.292) H25S(0.279) H25T(0.279) H25U(0.279)
 H28V(0.173) H28W(0.173) H28X(0.173) H29A(0.214) H29B(0.214) H29C(0.214)
 H30K(0.199) H30L(0.199) H30M(0.199) H33K(0.103) H33L(0.103) H33M(0.103)
 H34A(0.135) H34B(0.135) H34C(0.135) H35G(0.128) H35H(0.128) H35I(0.128)
 H38A(0.231) H38B(0.231) H38C(0.231) H39A(0.159) H39B(0.159) H39C(0.159)
 H40A(0.289) H40B(0.289) H40C(0.289) H43A(0.141) H43B(0.141) H43C(0.141)
 H44A(0.158) H44B(0.158) H44C(0.158) H45A(0.136) H45B(0.136) H45C(0.136)
 H48A(0.16) H48B(0.16) H48C(0.16) H49A(0.146) H49B(0.146) H49C(0.146)
 H50A(0.149) H50B(0.149) H50C(0.149) H53A(0.114) H53B(0.114) H53C(0.114)
 H54A(0.105) H54B(0.105) H54C(0.105) H55A(0.127) H55B(0.127) H55C(0.127)
 H58A(0.129) H58B(0.129) H58C(0.129) H59A(0.14) H59B(0.14) H59C(0.14)
 H60A(0.139) H60B(0.139) H60C(0.139) H63A(0.212) H63B(0.212) H63C(0.212)
 H64A(0.163) H64B(0.163) H64C(0.163) H65A(0.264) H65B(0.264) H65C(0.264)
 H68A(0.262) H68B(0.262) H68C(0.262) H69A(0.147) H69B(0.147) H69C(0.147)
 H70A(0.286) H70B(0.286) H70C(0.286) H81A(0.253) H81B(0.253) H81C(0.253)
 H82A(0.201) H82B(0.201) H82C(0.201) H83A(0.193) H83B(0.193) H83C(0.193)
 H76A(0.17) H76B(0.17) H76C(0.17) H77A(0.16) H77B(0.16) H77C(0.16) H78A(0.126)
 H78B(0.126) H78C(0.126) H73A(0.167) H73B(0.167) H73C(0.167) H74A(0.129)
 H74B(0.129) H74C(0.129) H75A(0.159) H75B(0.159) H75C(0.159)
 Fixed X: H2A(0.7027) H2B(0.7587) H4A(1.1845) H4B(1.1726) H6A(0.3197)
 H6B(0.3019) H25A(0.8808) H25B(0.8676) H25C(0.8272) H25D(0.7937) H25E(0.7627)
 H25F(0.754) H25G(0.8952) H25H(0.8532) H25I(0.8835) H26A(0.5582) H26B(0.6077)
 H26C(0.6138) H26D(0.5083) H26E(0.5313) H26F(0.5591) H27A(0.5158) H27B(0.5706)
 H27C(0.5372) H27D(0.6879) H27E(0.6301) H27F(0.6642) H27G(0.6683) H27H(0.6518)
 H27I(0.6178) H27J(0.7585) H27K(0.766) H27L(0.7417) H27M(0.6939) H27N(0.6421)
 H27O(0.6376) H27P(0.5877) H27Q(0.5913) H27R(0.6078) H28A(0.7305) H28B(0.6962)
 H28C(0.6797) H289(0.7195) H290(0.7203) H292(0.802) H293(0.7986) H295(0.8285)
 H296(0.815) H298(0.6584) H299(0.6731) H30A(0.7521) H30B(0.6905) H30C(0.6803)
 H30D(0.7414) H30E(0.7516) H30F(0.6909) H30G(0.6681) H30H(0.7289) H30I(0.6761)
 H30J(0.7359) H306(0.7297) H307(0.7062) H308(0.6492) H309(0.6043) H310(0.6311)
 H317(0.6231) H318(0.5435) H320(0.4665) H321(0.5479) H324(0.3978) H323(0.4763)
 H327(0.3948) H326(0.3162) H33A(0.2693) H33B(0.2871) H33C(0.2343) H33D(0.2143)
 H33E(0.2413) H33F(0.2637) H33G(0.1546) H33H(0.1762) H33I(0.1994) H33J(0.1776)
 H338(0.0838) H339(-0.0002) H340(-0.018) H341(0.0475) H342(0.133) H343(0.8912)
 H344(0.9635) H346(0.8952) H347(0.8245) H35A(1.1336) H35B(1.1207) H35C(1.2151)
 H35D(1.2402) H35E(1.2285) H35F(1.2202) H26G(0.9225) H26H(0.8711) H26I(0.8686)
 H26J(0.9702) H26K(0.946) H26L(0.9173) H26M(0.9704) H26N(0.918) H26O(0.9488)
 H28D(0.7414) H28E(0.7081) H28F(0.7018) H28G(0.8155) H28H(0.7819) H28I(0.835)
 H28J(0.8227) H28K(0.8386) H28L(0.7888) H328(0.4649) H329(0.3856) H330(0.3297)
 H331(0.4072) H354(0.9529) H355(1.0293) H356(1.1159) H357(1.0397) H36A(1.2565)
 H36B(1.2769) H36C(1.3234) H36D(1.3164) H36E(1.3537) H36F(1.3846) H364(1.3603)
 H365(1.4296) H366(1.5171) H367(1.5354) H368(1.4661) H26P(0.8843) H26Q(0.9431)
 H26R(0.9292) H26S(0.9786) H26T(0.942) H26U(0.9585) H26V(0.8554) H26W(0.8784)
 H26X(0.9149) H28M(0.7426) H28N(0.7436) H28O(0.6991) H28P(0.8347) H28Q(0.8542)
 H28R(0.8423) H28S(0.7773) H28T(0.7854) H28U(0.728) H349(0.9879) H350(1.06)
 H352(1.0777) H353(1.0049) H36G(1.2868) H36H(1.2679) H37A(1.3113) H37B(1.3477)
 H37C(1.3402) H37D(1.3569) H373(1.4104) H374(1.5008) H375(1.5583) H376(1.5256)
 H377(1.4352) H94A(0.1455) H94B(0.1019) H94C(0.0853) H95A(0.0586) H95B(0.076)
 H95C(0.0423) H96A(0.17) H96B(0.1105) H96C(0.1442) H99A(0.2238) H99B(0.17)
 H99C(0.2202) H10A(0.295) H10B(0.3018) H10C(0.2972) H10D(0.2111) H10E(0.2124)
 H10F(0.1622) H10G(0.0433) H10H(-0.0172) H10I(0.0072) H10J(0.0716) H10K(0.0533)
 H10L(0.0122) H10M(-0.0077) H10N(-0.0243) H10O(-0.0487) H10P(0.0751)
 H10Q(0.1149) H10R(0.0552) H11A(-0.0036) H11B(0.0039) H11C(-0.0158) H11D(0.06)
 H11E(0.0458) H11F(0.1055) H11G(0.0264) H11H(0.0021) H11I(0.0631) H11J(-0.0085)
 H11K(0.0061) H11L(-0.0334) H11M(0.0625) H11N(0.0852) H11O(0.0242) H11P(0.3851)
 H11Q(0.4003) H11R(0.3928) H12A(0.3323) H12B(0.2745) H12C(0.3228) H12D(0.3045)
 H12E(0.2613) H12F(0.3169) H12G(0.1423) H12H(0.1106) H12I(0.1005) H12J(0.2295)
 H12K(0.2424) H12L(0.2007) H12M(0.1183) H12N(0.1309) H12O(0.1726) H12P(0.4528)
 H12Q(0.4434) H12R(0.4) H13A(0.3432) H13B(0.3316) H13C(0.3749) H13D(0.4255)
 H13E(0.46) H13F(0.4685) H14A(0.5535) H14B(0.5343) H14C(0.5891) H14D(0.5524)
 H14E(0.5889) H14F(0.5346) H14G(0.5046) H14H(0.5044) H14I(0.5588) H14J(0.5034)
 H14K(0.4909) H14L(0.4488) H14M(0.4801) H14N(0.5108) H14O(0.523) H14P(0.3944)
 H14Q(0.3795) H14R(0.4216) H15A(0.5737) H15B(0.5465) H15C(0.6) H15D(0.571)
 H15E(0.5982) H15F(0.5431) H15G(0.5569) H15H(0.505) H15I(0.5023) H15J(0.2916)
 H15K(0.2777) H15L(0.3351) H15M(0.357) H15N(0.3985) H15O(0.3799) H15P(0.2632)
 H15Q(0.2902) H15R(0.2496) H16A(0.3697) H16B(0.4266) H16C(0.3981) H16D(0.4963)
 H16E(0.4787) H16F(0.5072) H16G(0.4521) H16H(0.4586) H16I(0.4017) H16J(0.3625)
 H16K(0.4108) H16L(0.3792) H16M(0.2699) H16N(0.2832) H16O(0.2587) H16P(0.3947)
 H16Q(0.3364) H16R(0.3609) H86A(0.1583) H86B(0.1401) H86C(0.1486) H87A(0.2787)
 H87B(0.2228) H87C(0.241) H88A(0.2918) H88B(0.2544) H88C(0.2449) H13G(0.2804)
 H13H(0.2212) H13I(0.2394) H13J(0.167) H13K(0.1491) H13L(0.1634) H13M(0.2789)
 H13N(0.2348) H13O(0.2205) H89A(0.1638) H89B(0.2235) H89C(0.1949) H90A(0.1388)
 H90B(0.1683) H90C(0.1808) H91A(0.2774) H91B(0.2658) H91C(0.2943) H13P(0.1731)
 H13Q(0.2158) H13R(0.1699) H13S(0.2093) H13T(0.1658) H13U(0.1664) H13V(0.282)
 H13W(0.2362) H13X(0.2822) H17A(1.2831) H17B(1.3219) H17C(1.2645) H17D(1.3639)
 H17E(1.3437) H17F(1.305) H17G(1.351) H17H(1.3747) H17I(1.3917) H17J(1.0673)
 H17K(1.0477) H17L(1.0449) H17M(1.1556) H17N(1.1) H17O(1.1028) H17P(1.1532)
 H17Q(1.1884) H17R(1.1364) H18A(1.1578) H18B(1.2181) H18C(1.2025) H18D(1.2493)
 H18E(1.2595) H18F(1.2752) H18G(1.1195) H18H(1.1639) H18I(1.154) H18J(0.9831)
 H18K(0.9392) H18L(0.9933) H18M(0.9879) H18N(0.9969) H18O(0.9423) H18P(1.005)
 H18Q(0.953) H18R(1.0076) H19A(1.3196) H19B(1.2896) H19C(1.3478) H19D(1.3334)
 H19E(1.3643) H19F(1.3162) H19G(1.2588) H19H(1.2687) H19I(1.3168) H19J(1.1102)
 H19K(1.0614) H19L(1.0521) H19M(1.1552) H19N(1.1258) H19O(1.1087) H19P(1.0316)
 H19Q(1.0042) H19R(1.0135) H20A(1.0946) H20B(1.1423) H20C(1.1348) H20D(1.1694)
 H20E(1.1107) H20F(1.1497) H20G(1.2433) H20H(1.2308) H20I(1.2383) H20J(0.9693)
 H20K(0.926) H20L(0.9668) H20M(0.9949) H20N(1.0135) H20O(0.9532) H20P(1.0156)
 H20Q(0.9957) H20R(0.9549) H21A(1.329) H21B(1.3374) H21C(1.3855) H21D(1.3291)
 H21E(1.3861) H21F(1.3395) H21G(1.3512) H21H(1.3534) H21I(1.3999) H22A(1.293)
 H22B(1.336) H22C(1.3211) H22D(1.2045) H22E(1.2305) H22F(1.1907) H22G(1.2603)
 H22H(1.3012) H22I(1.3161) H23A(1.0291) H23B(0.9865) H23C(1.0127) H23D(1.1015)
 H23E(1.0416) H23F(1.0844) H23G(1.079) H23H(1.0442) H23I(1.018) H23J(1.4412)
 H23K(1.3913) H23L(1.3908) H23M(1.432) H23N(1.3783) H23O(1.3802) H23P(1.4382)
 H23Q(1.3878) H23R(1.3864) H24A(1.1828) H24B(1.1808) H24C(1.1451) H24D(1.3057)
 H24E(1.278) H24F(1.2788) H24G(1.2489) H24H(1.1866) H24I(1.2223) H24J(1.2784)
 H24K(1.3279) H24L(1.3335) H24M(1.2326) H24N(1.2861) H24O(1.2546) H24P(1.3621)
 H24Q(1.3356) H24R(1.3672) H25J(1.1304) H25K(1.096) H25L(1.148) H25M(1.0533)
 H25N(1.0208) H25O(1.0151) H25P(1.0451) H25Q(1.0955) H25R(1.0435) H22J(1.2303)
 H22K(1.2163) H22L(1.2041) H22M(1.1661) H22N(1.1364) H22O(1.1044) H22P(1.1037)
 H22Q(1.1186) H22R(1.0754) H21J(1.18) H21K(1.1871) H21L(1.222) H21M(1.0659)
 H21N(1.0857) H21O(1.0794) H21P(1.1185) H21Q(1.1364) H21R(1.1794) H3A(0.5796)
 H3B(0.598) H3C(0.6294) H4C(0.7154) H4D(0.7141) H4E(0.6828) H5A(0.5805)
 H5B(0.6327) H5C(0.6008) H8A(0.6329) H8B(0.6208) H8C(0.5912) H9A(0.7252)
 H9B(0.7479) H9C(0.7161) H10S(0.6819) H10T(0.621) H10U(0.6506) H13Y(0.6625)
 H(0.6309) HA(0.6367) H14S(0.5029) H14T(0.5371) H14U(0.5312) H15S(0.5457)
 H15T(0.5768) H15U(0.6081) H18S(0.4799) H18T(0.4564) H18U(0.418) H19S(0.4686)
 H19T(0.4065) H19U(0.4386) H20S(0.4015) H20T(0.3695) H20U(0.4079) H23S(0.4452)
 H23T(0.4387) H23U(0.388) H24S(0.4278) H24T(0.3689) H24U(0.4018) H25S(0.4061)
 H25T(0.388) H25U(0.3551) H28V(0.5782) H28W(0.5751) H28X(0.5378) H29A(0.4501)
 H29B(0.4551) H29C(0.4923) H30K(0.5083) H30L(0.467) H30M(0.4562) H33K(0.6742)
 H33L(0.6364) H33M(0.67) H34A(0.5381) H34B(0.585) H34C(0.5514) H35G(0.5467)
 H35H(0.5614) H35I(0.5998) H38A(0.4994) H38B(0.5016) H38C(0.5404) H39A(0.5048)
 H39B(0.5528) H39C(0.5107) H40A(0.6259) H40B(0.6211) H40C(0.5822) H43A(0.7518)
 H43B(0.7311) H43C(0.7712) H44A(0.845) H44B(0.8685) H44C(0.884) H45A(0.854)
 H45B(0.8351) H45C(0.7951) H48A(0.7946) H48B(0.7671) H48C(0.8252) H49A(0.8092)
 H49B(0.8412) H49C(0.7944) H50A(0.7164) H50B(0.6977) H50C(0.6899) H53A(0.9625)
 H53B(0.9324) H53C(0.902) H54A(1.0312) H54B(1.0139) H54C(0.9985) H55A(0.9851)
 H55B(0.9258) H55C(0.9713) H58A(0.9602) H58B(0.9873) H58C(0.9262) H59A(1.0265)
 H59B(1.0342) H59C(1.0553) H60A(1.0004) H60B(0.9831) H60C(0.9396) H63A(1.0192)
 H63B(1.0782) H63C(1.0343) H64A(1.0545) H64B(1.0563) H64C(1.1002) H65A(1.0349)
 H65B(1.0797) H65C(1.0213) H68A(0.9506) H68B(0.9544) H68C(0.9471) H69A(0.8675)
 H69B(0.8631) H69C(0.8155) H70A(0.8726) H70B(0.8188) H70C(0.8664) H81A(0.9263)
 H81B(0.8737) H81C(0.923) H82A(0.9524) H82B(0.9497) H82C(0.9172) H83A(0.835)
 H83B(0.8663) H83C(0.817) H76A(0.7698) H76B(0.7651) H76C(0.7992) H77A(0.9056)
 H77B(0.856) H77C(0.8852) H78A(0.8971) H78B(0.8786) H78C(0.8446) H73A(0.7955)
 H73B(0.7552) H73C(0.789) H74A(0.842) H74B(0.8591) H74C(0.7984) H75A(0.8961)
 H75B(0.8851) H75C(0.9165)
 Fixed Y: H2A(1.0808) H2B(1.0819) H4A(0.4061) H4B(0.4201) H6A(0.7859)
 H6B(0.8168) H25A(0.7201) H25B(0.7304) H25C(0.7514) H25D(0.6903) H25E(0.6622)
 H25F(0.7144) H25G(0.6413) H25H(0.6156) H25I(0.6446) H26A(0.817) H26B(0.8222)
 H26C(0.7863) H26D(0.8073) H26E(0.7686) H26F(0.8104) H27A(0.7493) H27B(0.717)
 H27C(0.7127) H27D(0.8356) H27E(0.8267) H27F(0.8404) H27G(0.7254) H27H(0.7724)
 H27I(0.7587) H27J(0.7416) H27K(0.7844) H27L(0.7891) H27M(0.6088) H27N(0.5934)
 H27O(0.6331) H27P(0.5949) H27Q(0.5565) H27R(0.5449) H28A(0.5328) H28B(0.5062)
 H28C(0.5178) H289(0.795) H290(0.8662) H292(0.8881) H293(0.8159) H295(0.9416)
 H296(1.0187) H298(1.0219) H299(0.9451) H30A(1.0904) H30B(1.0912) H30C(1.1539)
 H30D(1.155) H30E(1.1443) H30F(1.1415) H30G(1.2165) H30H(1.2191) H30I(1.2068)
 H30J(1.2123) H306(1.2905) H307(1.3684) H308(1.3923) H309(1.3429) H310(1.2662)
 H317(0.6608) H318(0.6819) H320(0.6832) H321(0.6616) H324(0.7695) H323(0.7404)
 H327(0.6734) H326(0.7025) H33A(0.7635) H33B(0.7299) H33C(0.78) H33D(0.8123)
 H33E(0.8715) H33F(0.8393) H33G(0.8604) H33H(0.8264) H33I(0.8849) H33J(0.9189)
 H338(0.9429) H339(0.9583) H340(0.917) H341(0.8662) H342(0.8551) H343(0.564)
 H344(0.5114) H346(0.503) H347(0.5553) H35A(0.3554) H35B(0.3705) H35C(0.3467)
 H35D(0.348) H35E(0.3389) H35F(0.3593) H26G(0.7434) H26H(0.7648) H26I(0.7269)
 H26J(0.7259) H26K(0.6963) H26L(0.7457) H26M(0.6648) H26N(0.6457) H26O(0.6367)
 H28D(0.5844) H28E(0.6243) H28F(0.5749) H28G(0.5344) H28H(0.5217) H28I(0.5396)
 H28J(0.6168) H28K(0.6218) H28L(0.6537) H328(0.6757) H329(0.7032) H330(0.7704)
 H331(0.7414) H354(0.4196) H355(0.3753) H356(0.4607) H357(0.5047) H36A(0.4035)
 H36B(0.4109) H36C(0.3324) H36D(0.342) H36E(0.4099) H36F(0.3708) H364(0.367)
 H365(0.3575) H366(0.3516) H367(0.3552) H368(0.3647) H26P(0.7722) H26Q(0.7583)
 H26R(0.7492) H26S(0.6787) H26T(0.6424) H26U(0.663) H26V(0.7361) H26W(0.6863)
 H26X(0.7225) H28M(0.5306) H28N(0.5451) H28O(0.5698) H28P(0.5395) H28Q(0.5847)
 H28R(0.555) H28S(0.6201) H28T(0.6504) H28U(0.6424) H349(0.4257) H350(0.3776)
 H352(0.4608) H353(0.5109) H36G(0.3776) H36H(0.4138) H37A(0.3436) H37B(0.3453)
 H37C(0.3971) H37D(0.4185) H373(0.3769) H374(0.3524) H375(0.3285) H376(0.329)
 H377(0.3534) H94A(1.0072) H94B(0.9861) H94C(1.0207) H95A(0.9303) H95B(0.9172)
 H95C(0.9647) H96A(0.9876) H96B(0.9998) H96C(0.9523) H99A(0.6594) H99B(0.6789)
 H99C(0.6575) H10A(0.7439) H10B(0.6995) H10C(0.698) H10D(0.7734) H10E(0.7275)
 H10F(0.7489) H10G(0.8997) H10H(0.8973) H10I(0.8963) H10J(0.8354) H10K(0.7897)
 H10L(0.8308) H10M(0.7833) H10N(0.8242) H10O(0.8252) H10P(0.662) H10Q(0.6176)
 H10R(0.6162) H11A(0.6672) H11B(0.6917) H11C(0.6458) H11D(0.5993) H11E(0.5772)
 H11F(0.5786) H11G(0.8354) H11H(0.8385) H11I(0.8386) H11J(0.7652) H11K(0.7245)
 H11L(0.7677) H11M(0.7305) H11N(0.7743) H11O(0.7742) H11P(0.5702) H11Q(0.5612)
 H11R(0.61) H12A(0.5883) H12B(0.612) H12C(0.637) H12D(0.5342) H12E(0.5523)
 H12F(0.525) H12G(0.5469) H12H(0.5405) H12I(0.5868) H12J(0.524) H12K(0.5471)
 H12L(0.515) H12M(0.6229) H12N(0.577) H12O(0.6091) H12P(0.5697) H12Q(0.5343)
 H12R(0.55) H13A(0.6058) H13B(0.5722) H13C(0.5565) H13D(0.6343) H13E(0.586)
 H13F(0.6213) H14A(0.7397) H14B(0.6967) H14C(0.6924) H14D(0.7573) H14E(0.7111)
 H14F(0.7258) H14G(0.6441) H14H(0.6548) H14I(0.6402) H14J(0.7308) H14K(0.7478)
 H14L(0.7265) H14M(0.848) H14N(0.822) H14O(0.8049) H14P(0.8434) H14Q(0.7981)
 H14R(0.8194) H15A(0.8511) H15B(0.8969) H15C(0.8936) H15D(0.8385) H15E(0.8798)
 H15F(0.8768) H15G(0.956) H15H(0.9596) H15I(0.9529) H15J(0.9705) H15K(0.9265)
 H15L(0.9267) H15M(1.0091) H15N(0.9642) H15O(0.9918) H15P(1.0122) H15Q(0.9963)
 H15R(0.9698) H16A(0.8571) H16B(0.8371) H16C(0.8088) H16D(0.8451) H16E(0.8011)
 H16F(0.8294) H16G(0.9205) H16H(0.9057) H16I(0.925) H16J(1.0321) H16K(1.0182)
 H16L(1.0676) H16M(1.0457) H16N(1.0823) H16O(1.0421) H16P(1.0138) H16Q(1.0222)
 H16R(1.0624) H86A(0.9713) H86B(0.9325) H86C(0.9762) H87A(0.8905) H87B(0.8779)
 H87C(0.917) H88A(0.9565) H88B(0.9874) H88C(0.9929) H13G(0.6868) H13H(0.692)
 H13I(0.6639) H13J(0.7123) H13K(0.7424) H13L(0.7643) H13M(0.7648) H13N(0.7979)
 H13O(0.776) H89A(0.9894) H89B(0.9951) H89C(1.0026) H90A(0.9277) H90B(0.9366)
 H90C(0.8893) H91A(0.8953) H91B(0.9432) H91C(0.9357) H13P(0.6953) H13Q(0.6715)
 H13R(0.7098) H13S(0.8039) H13T(0.7784) H13U(0.7902) H13V(0.7616) H13W(0.7501)
 H13X(0.7119) H17A(0.5771) H17B(0.57) H17C(0.5585) H17D(0.491) H17E(0.4508)
 H17F(0.4842) H17G(0.527) H17H(0.4781) H17I(0.5192) H17J(0.6293) H17K(0.6591)
 H17L(0.608) H17M(0.6132) H17N(0.5979) H17O(0.649) H17P(0.6536) H17Q(0.6461)
 H17R(0.6829) H18A(0.5164) H18B(0.5102) H18C(0.507) H18D(0.3928) H18E(0.4297)
 H18F(0.4329) H18G(0.4532) H18H(0.4415) H18I(0.4049) H18J(0.5099) H18K(0.4838)
 H18L(0.48) H18M(0.472) H18N(0.4197) H18O(0.4466) H18P(0.3998) H18Q(0.4016)
 H18R(0.3746) H19A(0.2525) H19B(0.214) H19C(0.2137) H19D(0.3103) H19E(0.2736)
 H19F(0.3087) H19G(0.2089) H19H(0.2443) H19I(0.2091) H19J(0.3303) H19K(0.3137)
 H19L(0.3486) H19M(0.2531) H19N(0.2209) H19O(0.2335) H19P(0.2488) H19Q(0.2984)
 H19R(0.2635) H20A(0.1431) H20B(0.1511) H20C(0.1022) H20D(0.1035) H20E(0.1151)
 H20F(0.073) H20G(0.1167) H20H(0.0851) H20I(0.134) H20J(0.2914) H20K(0.2952)
 H20L(0.328) H20M(0.2119) H20N(0.1966) H20O(0.2163) H20P(0.2529) H20Q(0.3039)
 H20R(0.2711) H21A(0.154) H21B(0.1946) H21C(0.1675) H21D(0.1576) H21E(0.1702)
 H21F(0.2) H21G(0.2657) H21H(0.2679) H21I(0.2382) H22A(0.2209) H22B(0.2518)
 H22C(0.2285) H22D(0.2457) H22E(0.2527) H22F(0.2922) H22G(0.3401) H22H(0.3007)
 H22I(0.324) H23A(0.3192) H23B(0.3583) H23C(0.3638) H23D(0.3609) H23E(0.3553)
 H23F(0.3171) H23G(0.4315) H23H(0.4349) H23I(0.4295) H23J(0.3546) H23K(0.3401)
 H23L(0.3511) H23M(0.4166) H23N(0.4513) H23O(0.4016) H23P(0.433) H23Q(0.4317)
 H23R(0.4692) H24A(0.4462) H24B(0.4891) H24C(0.4911) H24D(0.4754) H24E(0.4781)
 H24F(0.4359) H24G(0.5469) H24H(0.555) H24I(0.5531) H24J(0.6074) H24K(0.5696)
 H24L(0.62) H24M(0.6513) H24N(0.6668) H24O(0.6448) H24P(0.557) H24Q(0.5855)
 H24R(0.6075) H25J(0.6338) H25K(0.6518) H25L(0.6157) H25M(0.6102) H25N(0.578)
 H25O(0.6279) H25P(0.5529) H25Q(0.566) H25R(0.602) H22J(0.1286) H22K(0.1552)
 H22L(0.1067) H22M(0.1119) H22N(0.09) H22O(0.1273) H22P(0.1365) H22Q(0.1838)
 H22R(0.1775) H21J(0.091) H21K(0.1109) H21L(0.1221) H21M(0.1779) H21N(0.1455)
 H21O(0.126) H21P(0.1888) H21Q(0.1373) H21R(0.1681) H3A(1.188) H3B(1.1978)
 H3C(1.1571) H4C(1.2366) H4D(1.1875) H4E(1.2281) H5A(1.2658) H5B(1.2857)
 H5C(1.2751) H8A(1.2884) H8B(1.339) H8C(1.3046) H9A(1.2829) H9B(1.2982)
 H9C(1.3339) H10S(1.3257) H10T(1.3272) H10U(1.3615) H13Y(1.0407) H(1.0316)
 HA(1.0806) H14S(1.0781) H14T(1.104) H14U(1.055) H15S(1.0158) H15T(0.9916)
 H15U(1.0023) H18S(1.2699) H18T(1.2326) H18U(1.2747) H19S(1.2802) H19T(1.2846)
 H19U(1.2492) H20S(1.1901) H20T(1.2254) H20U(1.1832) H23S(0.9963) H23T(1.0267)
 H23U(1.0169) H24S(1.0274) H24T(1.0448) H24U(1.0779) H25S(1.1046) H25T(1.127)
 H25U(1.0938) H28V(1.196) H28W(1.2348) H28X(1.2411) H29A(1.2173) H29B(1.2545)
 H29C(1.2483) H30K(1.1612) H30L(1.2063) H30M(1.1675) H33K(0.8836) H33L(0.8572)
 H33M(0.8871) H34A(0.9523) H34B(0.9299) H34C(0.9001) H35G(0.9455) H35H(0.8932)
 H35I(0.9202) H38A(1.0765) H38B(1.0668) H38C(1.0955) H39A(1.0001) H39B(0.9644)
 H39C(0.9894) H40A(0.9891) H40B(1.0397) H40C(1.0111) H43A(0.9306) H43B(0.8998)
 H43C(0.8785) H44A(0.9435) H44B(0.8921) H44C(0.922) H45A(0.8708) H45B(0.8412)
 H45C(0.8625) H48A(1.0735) H48B(1.0379) H48C(1.043) H49A(1.1429) H49B(1.1086)
 H49C(1.1456) H50A(1.1362) H50B(1.1393) H50C(1.0982) H53A(0.8735) H53B(0.8955)
 H53C(0.8957) H54A(0.9219) H54B(0.9741) H54C(0.9451) H55A(0.9213) H55B(0.9461)
 H55C(0.9736) H58A(0.9924) H58B(1.0238) H58C(1.0365) H59A(0.9962) H59B(1.0427)
 H59C(1.0277) H60A(1.0974) H60B(1.112) H60C(1.1104) H63A(1.1158) H63B(1.095)
 H63C(1.065) H64A(1.0811) H64B(1.0433) H64C(1.0734) H65A(1.1592) H65B(1.1515)
 H65C(1.1739) H68A(1.1862) H68B(1.2133) H68C(1.2383) H69A(1.1921) H69B(1.2441)
 H69C(1.224) H70A(1.262) H70B(1.267) H70C(1.2872) H81A(1.1659) H81B(1.1783)
 H81C(1.2006) H82A(1.2173) H82B(1.2544) H82C(1.2647) H83A(1.2875) H83B(1.2762)
 H83C(1.2538) H76A(1.0283) H76B(1.0559) H76C(1.0074) H77A(1.0286) H77B(1.0103)
 H77C(0.9897) H78A(1.0754) H78B(1.0367) H78C(1.0852) H73A(1.0304) H73B(1.0586)
 H73C(1.0828) H74A(0.985) H74B(1.0085) H74C(1.0124) H75A(1.0251) H75B(1.0775)
 H75C(1.0523)
 Fixed Z: H2A(0.1359) H2B(0.1291) H4A(0.2374) H4B(0.1915) H6A(0.4908)
 H6B(0.4491) H25A(0.1407) H25B(0.0907) H25C(0.1214) H25D(0.0709) H25E(0.1096)
 H25F(0.0998) H25G(0.1531) H25H(0.1425) H25I(0.1042) H26A(0.135) H26B(0.1589)
 H26C(0.133) H26D(0.2076) H26E(0.2489) H26F(0.2314) H27A(0.1644) H27B(0.1641)
 H27C(0.2077) H27D(0.3075) H27E(0.321) H27F(0.3528) H27G(0.4038) H27H(0.4124)
 H27I(0.3806) H27J(0.3832) H27K(0.3455) H27L(0.3907) H27M(0.1701) H27N(0.1604)
 H27O(0.1814) H27P(0.242) H27Q(0.2193) H27R(0.2687) H28A(0.215) H28B(0.2521)
 H28C(0.2027) H289(0.1416) H290(0.0974) H292(0.191) H293(0.233) H295(0.1191)
 H296(0.0925) H298(0.0813) H299(0.1033) H30A(0.0556) H30B(0.0618) H30C(0.0961)
 H30D(0.0893) H30E(0.1648) H30F(0.1725) H30G(0.1282) H30H(0.1225) H30I(0.2045)
 H30J(0.1972) H306(0.1279) H307(0.1166) H308(0.1648) H309(0.2169) H310(0.2264)
 H317(0.3919) H318(0.4254) H320(0.3193) H321(0.2887) H324(0.4563) H323(0.426)
 H327(0.3707) H326(0.401) H33A(0.4288) H33B(0.4744) H33C(0.5131) H33D(0.4673)
 H33E(0.4846) H33F(0.5299) H33G(0.506) H33H(0.5505) H33I(0.5728) H33J(0.5282)
 H338(0.5179) H339(0.5456) H340(0.6151) H341(0.6568) H342(0.6287) H343(0.3178)
 H344(0.31) H346(0.2043) H347(0.215) H35A(0.25) H35B(0.1999) H35C(0.1922)
 H35D(0.2355) H35E(0.2309) H35F(0.1803) H26G(0.3243) H26H(0.2955) H26I(0.3394)
 H26J(0.2552) H26K(0.2324) H26L(0.2281) H26M(0.3293) H26N(0.3446) H26O(0.303)
 H28D(0.4733) H28E(0.438) H28F(0.4426) H28G(0.4534) H28H(0.4205) H28I(0.4048)
 H28J(0.4412) H28K(0.3919) H28L(0.4038) H328(0.458) H329(0.4887) H330(0.368)
 H331(0.3384) H354(0.2406) H355(0.2259) H356(0.2396) H357(0.2572) H36A(0.151)
 H36B(0.1935) H36C(0.207) H36D(0.1562) H36E(0.1623) H36F(0.1993) H364(0.089)
 H365(0.0401) H366(0.0608) H367(0.1303) H368(0.1791) H26P(0.2594) H26Q(0.277)
 H26R(0.2333) H26S(0.3047) H26T(0.3157) H26U(0.2669) H26V(0.3301) H26W(0.3556)
 H26X(0.346) H28M(0.421) H28N(0.4641) H28O(0.4288) H28P(0.4025) H28Q(0.397)
 H28R(0.444) H28S(0.4562) H28T(0.4086) H28U(0.425) H349(0.3028) H350(0.2904)
 H352(0.1715) H353(0.1868) H36G(0.2336) H36H(0.19) H37A(0.1673) H37B(0.204)
 H37C(0.1183) H37D(0.153) H373(0.0783) H374(0.0685) H375(0.1282) H376(0.1977)
 H377(0.2075) H94A(0.3387) H94B(0.3233) H94C(0.3505) H95A(0.3796) H95B(0.4289)
 H95C(0.4071) H96A(0.4144) H96B(0.4286) H96C(0.4504) H99A(0.3544) H99B(0.3284)
 H99C(0.3059) H10A(0.294) H10B(0.3326) H10C(0.284) H10D(0.2541) H10E(0.2443)
 H10F(0.2668) H10G(0.285) H10H(0.2825) H10I(0.327) H10J(0.2559) H10K(0.2781)
 H10L(0.2515) H10M(0.3447) H10N(0.364) H10O(0.3194) H10P(0.3753) H10Q(0.3965)
 H10R(0.3888) H11A(0.4672) H11B(0.4174) H11C(0.431) H11D(0.5035) H11E(0.4684)
 H11F(0.4762) H11G(0.481) H11H(0.5267) H11I(0.5176) H11J(0.4894) H11K(0.5312)
 H11L(0.5351) H11M(0.5894) H11N(0.5839) H11O(0.593) H11P(0.5265) H11Q(0.4809)
 H11R(0.4854) H12A(0.4203) H12B(0.4288) H12C(0.425) H12D(0.5316) H12E(0.4943)
 H12F(0.4858) H12G(0.5925) H12H(0.6369) H12I(0.6008) H12J(0.6301) H12K(0.6649)
 H12L(0.6759) H12M(0.6548) H12N(0.6913) H12O(0.6802) H12P(0.6387) H12Q(0.683)
 H12R(0.6459) H13A(0.7233) H13B(0.6988) H13C(0.7359) H13D(0.7119) H13E(0.723)
 H13F(0.6784) H14A(0.5789) H14B(0.6087) H14C(0.5839) H14D(0.4992) H14E(0.5005)
 H14F(0.4749) H14G(0.5724) H14H(0.5211) H14I(0.5467) H14J(0.6792) H14K(0.721)
 H14L(0.7039) H14M(0.6348) H14N(0.6787) H14O(0.6369) H14P(0.6681) H14Q(0.6968)
 H14R(0.714) H15A(0.4383) H15B(0.4065) H15C(0.4302) H15D(0.5199) H15E(0.516)
 H15F(0.5401) H15G(0.4626) H15H(0.4366) H15I(0.4875) H15J(0.5801) H15K(0.5743)
 H15L(0.5895) H15M(0.5291) H15N(0.5369) H15O(0.489) H15P(0.5036) H15Q(0.4639)
 H15R(0.494) H16A(0.2649) H16B(0.2503) H16C(0.2905) H16D(0.3425) H16E(0.34)
 H16F(0.2998) H16G(0.2963) H16H(0.253) H16I(0.2682) H16J(0.399) H16K(0.3702)
 H16L(0.3575) H16M(0.3718) H16N(0.3297) H16O(0.325) H16P(0.2955) H16Q(0.2775)
 H16R(0.2822) H86A(0.1848) H86B(0.2222) H86C(0.2325) H87A(0.2098) H87B(0.2067)
 H87C(0.1698) H88A(0.2237) H88B(0.185) H88C(0.2325) H13G(0.7239) H13H(0.7408)
 H13I(0.7074) H13J(0.6562) H13K(0.6878) H13L(0.6387) H13M(0.6963) H13N(0.6643)
 H13O(0.7134) H89A(0.2376) H89B(0.2379) H89C(0.1932) H90A(0.2213) H90B(0.1758)
 H90C(0.2102) H91A(0.2086) H91B(0.1753) H91C(0.22) H13P(0.6741) H13Q(0.7111)
 H13R(0.7176) H13S(0.6417) H13T(0.6332) H13U(0.6778) H13V(0.6986) H13W(0.7326)
 H13X(0.7262) H17A(0.0529) H17B(0.0144) H17C(0.0166) H17D(0.0141) H17E(0.0481)
 H17F(0.0117) H17G(0.1101) H17H(0.1082) H17I(0.073) H17J(0.0902) H17K(0.0433)
 H17L(0.0578) H17M(-0.015) H17N(-0.0077) H17O(-0.0223) H17P(0.0765)
 H17Q(0.0364) H17R(0.0288) H18A(-0.0581) H18B(-0.0461) H18C(-0.092) H18D(-
 0.0336) H18E(-0.0766) H18F(-0.0307) H18G(-0.0635) H18H(-0.0967) H18I(-0.0534)
 H18J(0.0843) H18K(0.1097) H18L(0.1329) H18M(0.0232) H18N(0.035) H18O(0.0461)
 H18P(0.1507) H18Q(0.1257) H18R(0.1146) H19A(0.1694) H19B(0.1687) H19C(0.15)
 H19D(0.1024) H19E(0.0814) H19F(0.0563) H19G(0.0973) H19H(0.0531) H19I(0.0782)
 H19J(-0.0176) H19K(-0.0313) H19L(-0.0041) H19M(0.0188) H19N(0.0551)
 H19O(0.0057) H19P(0.0748) H19Q(0.0528) H19R(0.0255) H20A(0.1762) H20B(0.1434)
 H20C(0.1682) H20D(0.2744) H20E(0.2568) H20F(0.2499) H20G(0.2278) H20H(0.2013)
 H20I(0.1765) H20J(0.1858) H20K(0.2222) H20L(0.2106) H20M(0.2241) H20N(0.2733)
 H20O(0.2615) H20P(0.3118) H20Q(0.289) H20R(0.3006) H21A(0.2899) H21B(0.2498)
 H21C(0.2808) H21D(0.3628) H21E(0.3563) H21F(0.3748) H21G(0.2642) H21H(0.3127)
 H21I(0.2942) H22A(0.4569) H22B(0.4475) H22C(0.4961) H22D(0.4843) H22E(0.5248)
 H22F(0.4944) H22G(0.4817) H22H(0.5111) H22I(0.4626) H23A(0.3853) H23B(0.3943)
 H23C(0.3477) H23D(0.4512) H23E(0.4584) H23F(0.4478) H23G(0.3929) H23H(0.3525)
 H23I(0.3991) H23J(0.3014) H23K(0.3287) H23L(0.2774) H23M(0.3416) H23N(0.3368)
 H23O(0.3652) H23P(0.2563) H23Q(0.231) H23R(0.2544) H24A(0.4425) H24B(0.4581)
 H24C(0.4187) H24D(0.4082) H24E(0.4529) H24F(0.4364) H24G(0.3654) H24H(0.3701)
 H24I(0.4094) H24J(0.265) H24K(0.265) H24L(0.2469) H24M(0.1972) H24N(0.1783)
 H24O(0.152) H24P(0.1976) H24Q(0.1525) H24R(0.1788) H25J(0.199) H25K(0.2347)
 H25L(0.2484) H25M(0.1734) H25N(0.2068) H25O(0.2075) H25P(0.2871) H25Q(0.3027)
 H25R(0.289) H22J(0.3993) H22K(0.4343) H22L(0.4441) H22M(0.3597) H22N(0.4027)
 H22O(0.3644) H22P(0.4523) H22Q(0.445) H22R(0.4153) H21J(0.4228) H21K(0.372)
 H21L(0.4049) H21M(0.395) H21N(0.366) H21O(0.4169) H21P(0.4484) H21Q(0.4704)
 H21R(0.4557) H3A(-0.1396) H3B(-0.1888) H3C(-0.153) H4C(-0.174) H4D(-0.1745)
 H4E(-0.2103) H5A(-0.1437) H5B(-0.1571) H5C(-0.1924) H8A(0.0509) H8B(0.0238)
 H8C(0.0125) H9A(0.0379) H9B(-0.0099) H9C(0.012) H10S(-0.0733) H10T(-0.0627)
 H10U(-0.0514) H13Y(-0.0366) H(-0.073) HA(-0.0759) H14S(-0.0413) H14T(-0.0789)
 H14U(-0.0761) H15S(0.0177) H15T(-0.0154) H15U(0.0203) H18S(-0.0695) H18T(-
 0.0815) H18U(-0.0741) H19S(0.0019) H19T(-0.0006) H19U(0.0389) H20S(0.0225)
 H20T(-0.0171) H20U(-0.0246) H23S(0.1771) H23T(0.2089) H23U(0.1904)
 H24S(0.1012) H24T(0.1136) H24U(0.0819) H25S(0.1827) H25T(0.1337) H25U(0.1655)
 H28V(0.2006) H28W(0.1566) H28X(0.1961) H29A(0.1255) H29B(0.1477) H29C(0.1082)
 H30K(0.229) H30L(0.22) H30M(0.2021) H33K(0.2361) H33L(0.2209) H33M(0.1861)
 H34A(0.1694) H34B(0.1444) H34C(0.1792) H35G(0.2488) H35H(0.2604) H35I(0.274)
 H38A(0.291) H38B(0.3422) H38C(0.3121) H39A(0.3015) H39B(0.3259) H39C(0.3525)
 H40A(0.355) H40B(0.3529) H40C(0.3829) H43A(0.3676) H43B(0.3439) H43C(0.3833)
 H44A(0.3574) H44B(0.3719) H44C(0.3261) H45A(0.2902) H45B(0.3348) H45C(0.2955)
 H48A(0.3598) H48B(0.3486) H48C(0.3319) H49A(0.2969) H49B(0.2736) H49C(0.2489)
 H50A(0.3237) H50B(0.2765) H50C(0.3163) H53A(0.1647) H53B(0.1997) H53C(0.158)
 H54A(0.1604) H54B(0.1473) H54C(0.1935) H55A(0.0913) H55B(0.0824) H55C(0.0803)
 H58A(0.2988) H58B(0.3173) H58C(0.306) H59A(0.2371) H59B(0.2055) H59C(0.2539)
 H60A(0.2679) H60B(0.2184) H60C(0.2555) H63A(-0.0189) H63B(-0.0035)
 H63C(0.0069) H64A(0.109) H64B(0.0858) H64C(0.0754) H65A(0.0685) H65B(0.0343)
 H65C(0.0182) H68A(0.1385) H68B(0.089) H68C(0.1256) H69A(0.1775) H69B(0.1658)
 H69C(0.1555) H70A(0.0516) H70B(0.0776) H70C(0.088) H81A(-0.108) H81B(-0.1357)
 H81C(-0.1546) H82A(-0.0753) H82B(-0.1205) H82C(-0.0801) H83A(-0.1244) H83B(-
 0.1648) H83C(-0.1459) H76A(-0.0261) H76B(-0.0758) H76C(-0.062) H77A(-0.0095)
 H77B(0.0151) H77C(-0.0212) H78A(-0.0859) H78B(-0.0995) H78C(-0.1133) H73A(-
 0.0937) H73B(-0.0686) H73C(-0.1077) H74A(-0.0224) H74B(0.0105) H74C(0.001)
 H75A(-0.0842) H75B(-0.1002) H75C(-0.0564)
;
_shelx_fab_checksum              36581
_shelx_shelxl_version_number     2014/7
_olex2_submission_special_instructions 'No special instructions were received'