#------------------------------------------------------------------------------
#$Date: 2016-03-21 10:20:33 +0200 (Mon, 21 Mar 2016) $
#$Revision: 178646 $
#$URL: svn://www.crystallography.net/cod/cif/4/07/57/4075706.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_4075706
loop_
_publ_author_name
'Alvarez, Celedonio M.'
'Alvarez, M. Angeles'
'García, M. Esther'
'Ramos, Alberto'
'Ruiz, Miguel A.'
'Lanfranchi, Maurizio'
'Tiripicchio, Antonio'
_publ_section_title
;
 A Triply Bonded Dimolybdenum Hydride Complex with Acid, Base and Radical
 Activity
;
_journal_issue                   1
_journal_name_full               Organometallics
_journal_page_first              7
_journal_paper_doi               10.1021/om0491948
_journal_volume                  24
_journal_year                    2005
_chemical_formula_sum            'C24 H33 Mo2 O2 P'
_chemical_formula_weight         576.35
_chemical_name_systematic
;
 ?
;
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_date             2003-08-05T09:57:13-00:00
_audit_creation_method           'WinGX routine CIF_UPDATE'
_cell_angle_alpha                90
_cell_angle_beta                 103.27(2)
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   35.081(12)
_cell_length_b                   8.798(3)
_cell_length_c                   16.104(6)
_cell_measurement_temperature    293(2)
_cell_volume                     4838(3)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.997
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_unetI/netI     0.1613
_diffrn_reflns_limit_h_max       40
_diffrn_reflns_limit_h_min       -41
_diffrn_reflns_limit_k_max       10
_diffrn_reflns_limit_k_min       0
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_limit_l_min       0
_diffrn_reflns_number            4407
_diffrn_reflns_theta_full        25
_diffrn_reflns_theta_max         25
_diffrn_reflns_theta_min         3.03
_exptl_absorpt_coefficient_mu    1.12
_exptl_absorpt_correction_type   none
_exptl_crystal_density_diffrn    1.583
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             2336
_refine_diff_density_max         0.842
_refine_diff_density_min         -0.539
_refine_diff_density_rms         0.119
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.874
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     176
_refine_ls_number_reflns         4256
_refine_ls_number_restraints     18
_refine_ls_restrained_S_all      0.946
_refine_ls_R_factor_all          0.1709
_refine_ls_R_factor_gt           0.0585
_refine_ls_shift/su_max          0.047
_refine_ls_shift/su_mean         0.001
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0536P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1121
_refine_ls_wR_factor_ref         0.1453
_reflns_number_gt                1798
_reflns_number_total             4256
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            om0491948si20041019_052159.cif
_cod_data_source_block           a50b_(compound_1)
_cod_database_code               4075706
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, -y+1/2, z-1/2'
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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
C1 C 0.5688(3) 0.4714(16) 0.0822(8) 0.059(4) Uani 1 1 d . . .
C2 C 0.56673(19) 0.0270(8) -0.0126(4) 0.068(4) Uani 1 1 d . . .
C3 C 0.56482(19) 0.3664(8) -0.1635(4) 0.070(5) Uani 0.60(2) 1 d PR A 3
H3 H 0.5664 0.2775 -0.1937 0.084 Uiso 0.60(2) 1 calc PR A 3
C4 C 0.59673(19) 0.4613(8) -0.1249(4) 0.070(5) Uani 0.60(2) 1 d PR A 3
H4 H 0.6229 0.4454 -0.1255 0.084 Uiso 0.60(2) 1 calc PR A 3
C5 C 0.58170(19) 0.5847(8) -0.0854(4) 0.070(5) Uani 0.60(2) 1 d PR A 3
H5 H 0.5963 0.6638 -0.0555 0.084 Uiso 0.60(2) 1 calc PR A 3
C6 C 0.54051(19) 0.5661(8) -0.0995(4) 0.070(5) Uani 0.60(2) 1 d PR A 3
H6 H 0.5234 0.6309 -0.0805 0.084 Uiso 0.60(2) 1 calc PR A 3
C7 C 0.53007(19) 0.4312(8) -0.1478(4) 0.070(5) Uani 0.60(2) 1 d PR A 3
H7 H 0.5049 0.3922 -0.166 0.084 Uiso 0.60(2) 1 calc PR A 3
C8A C 0.53312(19) 0.0014(8) 0.1594(4) 0.074(8) Uani 0.37(3) 1 d PR B 1
H8A H 0.507 -0.0158 0.1326 0.088 Uiso 0.37(3) 1 calc PR B 1
C9A C 0.54788(19) 0.1284(8) 0.2113(4) 0.074(8) Uani 0.37(3) 1 d PR B 1
H9A H 0.5332 0.209 0.2245 0.088 Uiso 0.37(3) 1 calc PR B 1
C10A C 0.58905(19) 0.1107(8) 0.2396(4) 0.074(8) Uani 0.37(3) 1 d PR B 1
H10A H 0.606 0.1777 0.2745 0.088 Uiso 0.37(3) 1 calc PR B 1
C11A C 0.59975(19) -0.0272(8) 0.2051(4) 0.074(8) Uani 0.37(3) 1 d PR B 1
H11A H 0.625 -0.0664 0.2135 0.088 Uiso 0.37(3) 1 calc PR B 1
C12A C 0.56519(19) -0.0948(8) 0.1556(4) 0.074(8) Uani 0.37(3) 1 d PR B 1
H12A H 0.5638 -0.186 0.1259 0.088 Uiso 0.37(3) 1 calc PR B 1
C19 C 0.66020(19) 0.1365(8) 0.0102(4) 0.090(2) Uani 1 1 d D . .
H19 H 0.6406 0.0994 -0.0392 0.108 Uiso 1 1 calc R . .
C20 C 0.6745(4) -0.0163(13) 0.0534(9) 0.090(2) Uani 1 1 d D . .
H20A H 0.6934 0.0035 0.1064 0.108 Uiso 1 1 calc R . .
H20B H 0.6524 -0.069 0.0672 0.108 Uiso 1 1 calc R . .
C21 C 0.6931(4) -0.1189(14) -0.0027(9) 0.090(2) Uani 1 1 d D . .
H21A H 0.7074 -0.1991 0.0326 0.108 Uiso 1 1 calc R . .
H21B H 0.6724 -0.1664 -0.0451 0.108 Uiso 1 1 calc R . .
C22 C 0.7191(4) -0.0439(14) -0.0454(9) 0.090(2) Uani 1 1 d D . .
H22A H 0.7255 -0.1135 -0.0869 0.108 Uiso 1 1 calc R . .
H22B H 0.7432 -0.0214 -0.004 0.108 Uiso 1 1 calc R . .
C23 C 0.7039(4) 0.1005(14) -0.0903(9) 0.090(2) Uani 1 1 d D . .
H23A H 0.6836 0.0768 -0.1406 0.108 Uiso 1 1 calc R . .
H23B H 0.7249 0.152 -0.1088 0.108 Uiso 1 1 calc R . .
C24 C 0.6874(4) 0.2048(14) -0.0323(9) 0.090(2) Uani 1 1 d D . .
H24A H 0.709 0.2457 0.0105 0.108 Uiso 1 1 calc R . .
H24B H 0.6745 0.2895 -0.066 0.108 Uiso 1 1 calc R . .
O1 O 0.5689(3) 0.5508(12) 0.1411(7) 0.103(4) Uani 1 1 d . . .
O2 O 0.5692(3) -0.0518(12) -0.0707(6) 0.103(4) Uani 1 1 d . . .
P1 P 0.62831(8) 0.2482(4) 0.06380(16) 0.0369(7) Uani 1 1 d . . .
Mo1 Mo 0.56917(3) 0.35500(14) -0.01833(6) 0.0429(3) Uani 1 1 d . A .
Mo2 Mo 0.56905(3) 0.14346(13) 0.08783(6) 0.0420(3) Uani 1 1 d . B .
C8 C 0.53001(3) 0.06304(13) 0.18134(6) 0.067(5) Uani 0.63(3) 1 d PR B 2
H8 H 0.5047 0.1004 0.1752 0.081 Uiso 0.63(3) 1 calc PR B 2
C9 C 0.56455(3) 0.12685(13) 0.23321(6) 0.067(5) Uani 0.63(3) 1 d PR B 2
H9 H 0.5658 0.2133 0.267 0.081 Uiso 0.63(3) 1 calc PR B 2
C10 C 0.59677(3) 0.03546(13) 0.22449(6) 0.067(5) Uani 0.63(3) 1 d PR B 2
H10 H 0.6229 0.0516 0.2515 0.081 Uiso 0.63(3) 1 calc PR B 2
C11 C 0.58214(3) -0.08483(13) 0.16723(6) 0.067(5) Uani 0.63(3) 1 d PR B 2
H11 H 0.597 -0.1613 0.1502 0.081 Uiso 0.63(3) 1 calc PR B 2
C12 C 0.54088(3) -0.06778(13) 0.14056(6) 0.067(5) Uani 0.63(3) 1 d PR B 2
H12 H 0.524 -0.1312 0.103 0.081 Uiso 0.63(3) 1 calc PR B 2
C3A C 0.58891(3) 0.37693(13) -0.15226(6) 0.076(8) Uani 0.40(2) 1 d PR A 4
H3A H 0.6071 0.3111 -0.1666 0.091 Uiso 0.40(2) 1 calc PR A 4
C4A C 0.59745(3) 0.51653(13) -0.10762(6) 0.076(8) Uani 0.40(2) 1 d PR A 4
H4A H 0.6222 0.5581 -0.0876 0.091 Uiso 0.40(2) 1 calc PR A 4
C5A C 0.56152(3) 0.58143(13) -0.09885(6) 0.076(8) Uani 0.40(2) 1 d PR A 4
H5A H 0.5586 0.673 -0.0721 0.091 Uiso 0.40(2) 1 calc PR A 4
C6A C 0.53077(3) 0.48194(13) -0.13808(6) 0.076(8) Uani 0.40(2) 1 d PR A 4
H6A H 0.5042 0.4969 -0.1415 0.091 Uiso 0.40(2) 1 calc PR A 4
C7A C 0.54769(3) 0.35555(13) -0.17109(6) 0.076(8) Uani 0.40(2) 1 d PR A 4
H7A H 0.5342 0.2732 -0.2 0.091 Uiso 0.40(2) 1 calc PR A 4
C13 C 0.66050(3) 0.35976(13) 0.15029(6) 0.082(4) Uani 0.614(15) 1 d PRD C 5
H13 H 0.6423 0.4001 0.1828 0.098 Uiso 0.614(15) 1 calc PR C 5
C14 C 0.67710(3) 0.50725(13) 0.11495(6) 0.047(7) Uani 0.614(15) 1 d PRD C 5
H14A H 0.6577 0.5531 0.069 0.056 Uiso 0.614(15) 1 calc PR C 5
H14B H 0.7006 0.4851 0.0949 0.056 Uiso 0.614(15) 1 calc PR C 5
C15 C 0.68772(3) 0.62727(13) 0.20786(6) 0.077(8) Uani 0.614(15) 1 d PRD C 5
H15A H 0.6965 0.7269 0.1943 0.093 Uiso 0.614(15) 1 calc PR C 5
H15B H 0.6649 0.639 0.2316 0.093 Uiso 0.614(15) 1 calc PR C 5
C16 C 0.71864(3) 0.54708(13) 0.26641(6) 0.129(7) Uani 0.614(15) 1 d PRD C 5
H16A H 0.7309 0.6132 0.3131 0.154 Uiso 0.614(15) 1 calc PR C 5
H16B H 0.7385 0.514 0.2372 0.154 Uiso 0.614(15) 1 calc PR C 5
C17 C 0.69925(3) 0.40209(13) 0.30223(6) 0.055(7) Uani 0.614(15) 1 d PRD C 5
H17A H 0.6753 0.4294 0.3189 0.066 Uiso 0.614(15) 1 calc PR C 5
H17B H 0.7173 0.3557 0.3503 0.066 Uiso 0.614(15) 1 calc PR C 5
C18 C 0.69014(3) 0.28459(13) 0.21429(6) 0.047(6) Uani 0.614(15) 1 d PRD C 5
H18A H 0.7138 0.2696 0.1937 0.057 Uiso 0.614(15) 1 calc PR C 5
H18B H 0.6808 0.1863 0.2285 0.057 Uiso 0.614(15) 1 calc PR C 5
C13A C 0.66050(3) 0.35976(13) 0.15029(6) 0.082(4) Uani 0.386(15) 1 d PRD C 6
H13A H 0.6857 0.3165 0.1461 0.098 Uiso 0.386(15) 1 calc PR C 6
C14A C 0.66830(3) 0.52968(13) 0.12789(6) 0.041(11) Uani 0.386(15) 1 d PRD C 6
H14C H 0.6688 0.5373 0.0681 0.049 Uiso 0.386(15) 1 calc PR C 6
H14D H 0.6473 0.5939 0.1379 0.049 Uiso 0.386(15) 1 calc PR C 6
C15A C 0.70757(3) 0.58393(13) 0.18316(6) 0.065(13) Uani 0.386(15) 1 d PRD C 6
H15C H 0.7279 0.5478 0.1562 0.078 Uiso 0.386(15) 1 calc PR C 6
H15D H 0.7077 0.694 0.1797 0.078 Uiso 0.386(15) 1 calc PR C 6
C16A C 0.71864(3) 0.54708(13) 0.26641(6) 0.129(7) Uani 0.386(15) 1 d PRD C 6
H16C H 0.7039 0.6084 0.2982 0.154 Uiso 0.386(15) 1 calc PR C 6
H16D H 0.7462 0.5714 0.287 0.154 Uiso 0.386(15) 1 calc PR C 6
C17A C 0.71213(3) 0.37348(13) 0.28436(6) 0.066(13) Uani 0.386(15) 1 d PRD C 6
H17C H 0.7165 0.3554 0.3452 0.08 Uiso 0.386(15) 1 calc PR C 6
H17D H 0.7302 0.3108 0.2619 0.08 Uiso 0.386(15) 1 calc PR C 6
C18A C 0.66250(3) 0.32863(13) 0.23242(6) 0.058(11) Uani 0.386(15) 1 d PRD C 6
H18C H 0.6568 0.2223 0.2401 0.07 Uiso 0.386(15) 1 calc PR C 6
H18D H 0.6442 0.3908 0.2545 0.07 Uiso 0.386(15) 1 calc PR C 6
H1 H 0.529(3) 0.246(12) 0.015(5) 0.07(3) Uiso 1 1 d . . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0 0 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.006 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Mo Mo -1.6832 0.6857 '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
O1 C1 Mo1 175.8(12) . .
O2 C2 Mo2 172.7(8) . .
C4 C3 C7 108 . .
C4 C3 Mo1 73.77(17) . .
C7 C3 Mo1 72.38(16) . .
C3 C4 C5 108 . .
C3 C4 Mo1 70.76(18) . .
C5 C4 Mo1 73.70(17) . .
C6 C5 C4 108 . .
C6 C5 Mo1 71.80(16) . .
C4 C5 Mo1 71.36(17) . .
C5 C6 C7 108 . .
C5 C6 Mo1 73.33(16) . .
C7 C6 Mo1 70.67(18) . .
C6 C7 C3 108 . .
C6 C7 Mo1 73.98(18) . .
C3 C7 Mo1 71.87(16) . .
C12A C8A C9A 108 . .
C12A C8A Mo2 76.60(17) . .
C9A C8A Mo2 72.28(19) . .
C10A C9A C8A 108 . .
C10A C9A Mo2 76.99(17) . .
C8A C9A Mo2 71.34(18) . .
C9A C10A C11A 108 . .
C9A C10A Mo2 67.81(15) . .
C11A C10A Mo2 75.32(16) . .
C10A C11A C12A 108 . .
C10A C11A Mo2 70.73(17) . .
C12A C11A Mo2 69.94(17) . .
C8A C12A C11A 108 . .
C8A C12A Mo2 67.94(15) . .
C11A C12A Mo2 75.99(17) . .
C24 C19 C20 113.5(8) . .
C24 C19 P1 122.9(7) . .
C20 C19 P1 115.0(6) . .
C21 C20 C19 112.8(10) . .
C22 C21 C20 114.9(11) . .
C21 C22 C23 115.4(11) . .
C22 C23 C24 111.1(11) . .
C19 C24 C23 115.6(10) . .
C19 P1 C13A 107.6(3) . .
C19 P1 C13 107.6(3) . .
C13A P1 C13 0.00(10) . .
C19 P1 Mo1 119.6(2) . .
C13A P1 Mo1 120.64(15) . .
C13 P1 Mo1 120.64(15) . .
C19 P1 Mo2 120.9(3) . .
C13A P1 Mo2 118.99(13) . .
C13 P1 Mo2 118.99(13) . .
Mo1 P1 Mo2 64.03(8) . .
C1 Mo1 C3 145.0(4) . .
C1 Mo1 C7 119.2(4) . .
C3 Mo1 C7 35.75(10) . .
C1 Mo1 C4 119.2(4) . .
C3 Mo1 C4 35.48(9) . .
C7 Mo1 C4 59.00(14) . .
C1 Mo1 C5A 89.5(4) . .
C3 Mo1 C5A 55.53(17) . .
C7 Mo1 C5A 44.88(17) . .
C4 Mo1 C5A 43.61(16) . .
C1 Mo1 C6 87.9(4) . .
C3 Mo1 C6 58.94(14) . .
C7 Mo1 C6 35.34(9) . .
C4 Mo1 C6 58.41(14) . .
C5A Mo1 C6 18.22(16) . .
C1 Mo1 C6A 108.9(4) . .
C3 Mo1 C6A 42.35(16) . .
C7 Mo1 C6A 11.51(18) . .
C4 Mo1 C6A 57.92(16) . .
C5A Mo1 C6A 35 . .
C6 Mo1 C6A 23.85(18) . .
C1 Mo1 C5 88.1(4) . .
C3 Mo1 C5 58.65(14) . .
C7 Mo1 C5 58.57(14) . .
C4 Mo1 C5 34.94(8) . .
C5A Mo1 C5 16.78(16) . .
C6 Mo1 C5 34.87(9) . .
C6A Mo1 C5 50.10(17) . .
C1 Mo1 P1 85.1(4) . .
C3 Mo1 P1 115.20(18) . .
C7 Mo1 P1 150.94(17) . .
C4 Mo1 P1 96.35(17) . .
C5A Mo1 P1 127.80(8) . .
C6 Mo1 P1 145.49(19) . .
C6A Mo1 P1 154.12(8) . .
C5 Mo1 P1 111.02(18) . .
C1 Mo1 C4A 105.9(4) . .
C3 Mo1 C4A 46.07(17) . .
C7 Mo1 C4A 61.88(16) . .
C4 Mo1 C4A 13.48(18) . .
C5A Mo1 C4A 34.8 . .
C6 Mo1 C4A 51.85(15) . .
C6A Mo1 C4A 57.8 . .
C5 Mo1 C4A 22.72(16) . .
P1 Mo1 C4A 98.01(8) . .
C1 Mo1 C7A 143.4(4) . .
C3 Mo1 C7A 14.28(16) . .
C7 Mo1 C7A 25.27(17) . .
C4 Mo1 C7A 48.37(18) . .
C5A Mo1 C7A 57.7 . .
C6 Mo1 C7A 55.75(18) . .
C6A Mo1 C7A 34.7 . .
C5 Mo1 C7A 65.20(17) . .
P1 Mo1 C7A 126.72(8) . .
C4A Mo1 C7A 57.3 . .
C1 Mo1 C3A 140.2(4) . .
C3 Mo1 C3A 19.98(16) . .
C7 Mo1 C3A 53.55(16) . .
C4 Mo1 C3A 21.06(18) . .
C5A Mo1 C3A 57.5 . .
C6 Mo1 C3A 67.41(16) . .
C6A Mo1 C3A 57.4 . .
C5 Mo1 C3A 53.64(17) . .
P1 Mo1 C3A 97.78(8) . .
C4A Mo1 C3A 34.3 . .
C7A Mo1 C3A 34.3 . .
C2 Mo2 C8A 102.4(3) . .
C2 Mo2 C9A 138.7(3) . .
C8A Mo2 C9A 36.38(9) . .
C2 Mo2 C12 86.67(18) . .
C8A Mo2 C12 18.76(18) . .
C9A Mo2 C12 52.53(18) . .
C2 Mo2 C8 117.57(19) . .
C8A Mo2 C8 16.46(18) . .
C9A Mo2 C8 22.35(18) . .
C12 Mo2 C8 35 . .
C2 Mo2 C11 88.14(18) . .
C8A Mo2 C11 47.15(16) . .
C9A Mo2 C11 62.72(16) . .
C12 Mo2 C11 35 . .
C8 Mo2 C11 58.1 . .
C2 Mo2 C12A 85.4(3) . .
C8A Mo2 C12A 35.46(9) . .
C9A Mo2 C12A 59.01(14) . .
C12 Mo2 C12A 21.03(16) . .
C8 Mo2 C12A 48.89(15) . .
C11 Mo2 C12A 14.21(16) . .
C2 Mo2 P1 86.5(2) . .
C8A Mo2 P1 154.40(18) . .
C9A Mo2 P1 129.36(19) . .
C12 Mo2 P1 144.84(8) . .
C8 Mo2 P1 150.77(7) . .
C11 Mo2 P1 110.31(8) . .
C12A Mo2 P1 123.91(17) . .
C2 Mo2 C9 143.35(18) . .
C8A Mo2 C9 45.44(18) . .
C9A Mo2 C9 14.79(17) . .
C12 Mo2 C9 58 . .
C8 Mo2 C9 34.8 . .
C11 Mo2 C9 57.8 . .
C12A Mo2 C9 58.20(17) . .
P1 Mo2 C9 116.04(7) . .
C2 Mo2 C10 119.89(18) . .
C8A Mo2 C10 57.93(17) . .
C9A Mo2 C10 47.08(16) . .
C12 Mo2 C10 58 . .
C8 Mo2 C10 57.8 . .
C11 Mo2 C10 34.7 . .
C12A Mo2 C10 44.10(17) . .
P1 Mo2 C10 96.75(7) . .
C9 Mo2 C10 34.6 . .
C2 Mo2 C10A 138.4(3) . .
C8A Mo2 C10A 58.88(14) . .
C9A Mo2 C10A 35.20(9) . .
C12 Mo2 C10A 65.58(16) . .
C8 Mo2 C10A 52.58(16) . .
C11 Mo2 C10A 51.20(17) . .
C12A Mo2 C10A 57.44(13) . .
P1 Mo2 C10A 98.60(17) . .
C9 Mo2 C10A 20.55(15) . .
C10 Mo2 C10A 18.63(16) . .
C2 Mo2 C11A 104.5(3) . .
C8A Mo2 C11A 57.98(14) . .
C9A Mo2 C11A 57.84(14) . .
C12 Mo2 C11A 52.18(16) . .
C8 Mo2 C11A 62.85(15) . .
C11 Mo2 C11A 21.76(17) . .
C12A Mo2 C11A 34.07(8) . .
P1 Mo2 C11A 96.67(17) . .
C9 Mo2 C11A 47.55(16) . .
C10 Mo2 C11A 15.40(17) . .
C10A Mo2 C11A 33.95(8) . .
C12 C8 C9 108 . .
C12 C8 Mo2 72 . .
C9 C8 Mo2 73.5 . .
C10 C9 C8 108 . .
C10 C9 Mo2 72.8 . .
C8 C9 Mo2 71.7 . .
C9 C10 C11 108 . .
C9 C10 Mo2 72.6 . .
C11 C10 Mo2 71.8 . .
C12 C11 C10 108 . .
C12 C11 Mo2 71.9 . .
C10 C11 Mo2 73.4 . .
C11 C12 C8 108 . .
C11 C12 Mo2 73.1 . .
C8 C12 Mo2 72.9 . .
C4A C3A C7A 108 . .
C4A C3A Mo1 71.8 . .
C7A C3A Mo1 72.2 . .
C3A C4A C5A 108 . .
C3A C4A Mo1 73.9 . .
C5A C4A Mo1 71.3 . .
C6A C5A C4A 108 . .
C6A C5A Mo1 72.7 . .
C4A C5A Mo1 73.9 . .
C5A C6A C7A 108 . .
C5A C6A Mo1 72.3 . .
C7A C6A Mo1 74.1 . .
C3A C7A C6A 108 . .
C3A C7A Mo1 73.6 . .
C6A C7A Mo1 71.2 . .
C18 C13 C14 111.6 . .
C18 C13 P1 120.44(10) . .
C14 C13 P1 111.97(9) . .
C13 C14 C15 101.9 . .
C16 C15 C14 103.7 . .
C15 C16 C17 107.7 . .
C16 C17 C18 101.2 . .
C13 C18 C17 106.2 . .
C18A C13A C14A 116.6 . .
C18A C13A P1 121.19(9) . .
C14A C13A P1 115.88(10) . .
C15A C14A C13A 110 . .
C16A C15A C14A 121.2 . .
C15A C16A C17A 113.2 . .
C16A C17A C18A 107 . .
C13A C18A C17A 103.9 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
C1 O1 1.177(13) .
C1 Mo1 1.918(14) .
C2 O2 1.183(10) .
C2 Mo2 1.901(7) .
C3 C4 1.42 .
C3 C7 1.42 .
C3 Mo1 2.310(6) .
C4 C5 1.42 .
C4 Mo1 2.349(6) .
C5 C6 1.42 .
C5 Mo1 2.379(6) .
C6 C7 1.42 .
C6 Mo1 2.360(6) .
C7 Mo1 2.317(6) .
C8A C12A 1.42 .
C8A C9A 1.42 .
C8A Mo2 2.268(6) .
C9A C10A 1.42 .
C9A Mo2 2.281(6) .
C10A C11A 1.42 .
C10A Mo2 2.400(6) .
C11A C12A 1.42 .
C11A Mo2 2.459(6) .
C12A Mo2 2.381(6) .
C19 C24 1.428(11) .
C19 C20 1.543(11) .
C19 P1 1.846(7) .
C20 C21 1.526(13) .
C21 C22 1.423(13) .
C22 C23 1.499(13) .
C23 C24 1.515(13) .
P1 C13A 1.859(3) .
P1 C13 1.859(3) .
P1 Mo1 2.383(3) .
P1 Mo2 2.386(3) .
Mo1 C5A 2.3584(14) .
Mo1 C6A 2.3640(14) .
Mo1 C4A 2.3930(14) .
Mo1 C7A 2.4018(16) .
Mo1 C3A 2.4195(15) .
Mo2 C12 2.353 .
Mo2 C8 2.3644 .
Mo2 C11 2.3686 .
Mo2 C9 2.3869 .
Mo2 C10 2.3895 .
C8 C12 1.42 .
C8 C9 1.42 .
C9 C10 1.42 .
C10 C11 1.42 .
C11 C12 1.42 .
C3A C4A 1.42 .
C3A C7A 1.42 .
C4A C5A 1.42 .
C5A C6A 1.42 .
C6A C7A 1.42 .
C13 C18 1.4451 .
C13 C14 1.5807 .
C14 C15 1.7992 .
C15 C16 1.4472 .
C16 C17 1.6134 .
C17 C18 1.723 .
C13A C18A 1.3367 .
C13A C14A 1.5764 .
C14A C15A 1.5345 .
C15A C16A 1.347 .
C16A C17A 1.5807 .
C17A C18A 1.794 .
