#------------------------------------------------------------------------------
#$Date: 2016-03-05 11:45:59 +0200 (Sat, 05 Mar 2016) $
#$Revision: 177806 $
#$URL: svn://www.crystallography.net/cod/cif/7/03/79/7037935.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_7037935
loop_
_publ_author_name
'García, C Murcia'
'Ferao, A. Espinosa'
'Schnakenburg, G.'
'Streubel, R.'
_publ_section_title
;
 CPh3 as a functional group in P-heterocyclic chemistry: elimination of
 HCPh3 in the reaction of P-CPh3 substituted Li/Cl phosphinidenoid
 complexes with Ph2C[double bond, length as m-dash]O.
;
_journal_issue                   6
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              2378
_journal_page_last               2385
_journal_paper_doi               10.1039/c5dt04595a
_journal_volume                  45
_journal_year                    2016
_chemical_absolute_configuration ad
_chemical_formula_moiety         'C31 H21 Mo O6 P'
_chemical_formula_sum            'C31 H21 Mo O6 P'
_chemical_formula_weight         616.39
_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'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_audit_update_record
;
2015-09-10 deposited with the CCDC.
2016-01-04 downloaded from the CCDC.
;
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   8.6515(3)
_cell_length_b                   15.6935(4)
_cell_length_c                   19.9770(8)
_cell_measurement_reflns_used    8559
_cell_measurement_temperature    123(2)
_cell_measurement_theta_max      29.36
_cell_measurement_theta_min      2.87
_cell_volume                     2712.32(16)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      123(2)
_diffrn_measured_fraction_theta_full 0.995
_diffrn_measured_fraction_theta_max 0.995
_diffrn_measurement_device_type  'STOE IPDS2T'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0826
_diffrn_reflns_av_sigmaI/netI    0.1091
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_k_min       -20
_diffrn_reflns_limit_l_max       21
_diffrn_reflns_limit_l_min       -26
_diffrn_reflns_number            19516
_diffrn_reflns_theta_full        28.00
_diffrn_reflns_theta_max         28.00
_diffrn_reflns_theta_min         2.88
_exptl_absorpt_coefficient_mu    0.586
_exptl_absorpt_correction_T_max  0.9884
_exptl_absorpt_correction_T_min  0.9437
_exptl_absorpt_correction_type   integration
_exptl_absorpt_process_details   'STOE XRed'
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.509
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       rod
_exptl_crystal_F_000             1248
_exptl_crystal_size_max          0.10
_exptl_crystal_size_mid          0.03
_exptl_crystal_size_min          0.02
_refine_diff_density_max         0.592
_refine_diff_density_min         -0.653
_refine_diff_density_rms         0.081
_refine_ls_abs_structure_details 'Flack H D (1983), Acta Cryst. A39, 876-881'
_refine_ls_abs_structure_Flack   0.27(3)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.840
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     356
_refine_ls_number_reflns         6550
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.840
_refine_ls_R_factor_all          0.0646
_refine_ls_R_factor_gt           0.0432
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0039P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0549
_refine_ls_wR_factor_ref         0.0585
_reflns_number_gt                5083
_reflns_number_total             6550
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c5dt04595a2.cif
_cod_data_source_block           2463-new2
_cod_depositor_comments
;
The following automatic conversions were performed:

'_exptl_absorpt_correction_type' value 'Integration' changed to
'integration' according to
/usr/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 4268 2015-11-12 08:31:59Z antanas 

 Adding full bibliography for 7037934--7037937.cif.
;
_cod_database_code               7037935
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, -y, z+1/2'
'x+1/2, -y+1/2, -z'
'-x, 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
C1 C 1.1686(3) 0.9878(3) 0.1217(2) 0.0202(9) Uani 1 1 d .
H1 H 1.215(4) 0.977(3) 0.1613(18) 0.024 Uiso 1 1 d .
C2 C 1.2022(4) 1.0740(3) 0.09431(19) 0.0239(8) Uani 1 1 d .
C3 C 1.1234(4) 1.1450(3) 0.1172(2) 0.0275(10) Uani 1 1 d .
H3A H 1.0451 1.1385 0.1502 0.033 Uiso 1 1 calc R
C4 C 1.1567(5) 1.2245(3) 0.0930(3) 0.0352(11) Uani 1 1 d .
H4A H 1.1008 1.2726 0.1088 0.042 Uiso 1 1 calc R
C5 C 1.2714(5) 1.2348(3) 0.0458(2) 0.0397(12) Uani 1 1 d .
H5A H 1.2956 1.2900 0.0294 0.048 Uiso 1 1 calc R
C6 C 1.3516(4) 1.1642(3) 0.0223(3) 0.0407(11) Uani 1 1 d .
H6A H 1.4305 1.1709 -0.0103 0.049 Uiso 1 1 calc R
C7 C 1.3163(4) 1.0849(3) 0.0464(2) 0.0348(11) Uani 1 1 d .
H7A H 1.3709 1.0367 0.0301 0.042 Uiso 1 1 calc R
C8 C 0.9601(3) 0.8614(2) 0.1803(2) 0.0176(8) Uani 1 1 d .
C9 C 1.1089(4) 0.8397(2) 0.2207(2) 0.0175(8) Uani 1 1 d .
C10 C 1.2320(4) 0.7976(2) 0.1887(2) 0.0196(8) Uani 1 1 d .
H10A H 1.2263 0.7857 0.1422 0.024 Uiso 1 1 calc R
C11 C 1.3616(4) 0.7736(3) 0.2249(2) 0.0236(9) Uani 1 1 d .
H11A H 1.4459 0.7471 0.2026 0.028 Uiso 1 1 calc R
C12 C 1.3694(4) 0.7876(3) 0.2918(2) 0.0285(10) Uani 1 1 d .
H12A H 1.4583 0.7704 0.3163 0.034 Uiso 1 1 calc R
C13 C 1.2481(4) 0.8270(3) 0.3244(2) 0.0261(10) Uani 1 1 d .
H13A H 1.2531 0.8363 0.3714 0.031 Uiso 1 1 calc R
C14 C 1.1188(4) 0.8528(3) 0.2885(2) 0.0226(9) Uani 1 1 d .
H14 H 1.0359 0.8800 0.3112 0.027 Uiso 1 1 calc R
C15 C 0.8864(4) 0.7754(2) 0.1625(2) 0.0172(8) Uani 1 1 d .
C16 C 0.8962(4) 0.7390(3) 0.0996(2) 0.0236(9) Uani 1 1 d .
H16A H 0.9454 0.7695 0.0645 0.028 Uiso 1 1 calc R
C17 C 0.8358(4) 0.6592(3) 0.0869(2) 0.0298(11) Uani 1 1 d .
H17A H 0.8417 0.6361 0.0430 0.036 Uiso 1 1 calc R
C18 C 0.7672(4) 0.6128(3) 0.1372(2) 0.0298(11) Uani 1 1 d .
H18A H 0.7260 0.5579 0.1284 0.036 Uiso 1 1 calc R
C19 C 0.7592(4) 0.6471(3) 0.2005(2) 0.0254(10) Uani 1 1 d .
H19A H 0.7117 0.6156 0.2355 0.030 Uiso 1 1 calc R
C20 C 0.8193(4) 0.7268(2) 0.2138(2) 0.0200(8) Uani 1 1 d .
H20A H 0.8152 0.7490 0.2580 0.024 Uiso 1 1 calc R
C21 C 0.8516(4) 0.9240(3) 0.2179(2) 0.0177(8) Uani 1 1 d .
C22 C 0.9090(4) 0.9995(2) 0.2447(2) 0.0207(9) Uani 1 1 d .
H22A H 1.0167 1.0109 0.2420 0.025 Uiso 1 1 calc R
C23 C 0.8138(5) 1.0580(2) 0.2751(2) 0.0262(9) Uani 1 1 d .
H23A H 0.8566 1.1084 0.2939 0.031 Uiso 1 1 calc R
C24 C 0.6566(4) 1.0443(3) 0.2785(2) 0.0279(11) Uani 1 1 d .
H24A H 0.5905 1.0851 0.2987 0.033 Uiso 1 1 calc R
C25 C 0.5972(4) 0.9698(3) 0.2519(2) 0.0269(8) Uani 1 1 d .
H25A H 0.4894 0.9590 0.2552 0.032 Uiso 1 1 calc R
C26 C 0.6913(4) 0.9106(2) 0.22057(19) 0.0227(8) Uani 1 1 d .
H26A H 0.6475 0.8611 0.2009 0.027 Uiso 1 1 calc R
C27 C 0.6443(4) 1.0144(3) -0.0463(2) 0.0254(10) Uani 1 1 d .
C28 C 0.7307(4) 1.0695(3) 0.0844(2) 0.0241(9) Uani 1 1 d .
C29 C 0.6271(4) 0.8946(3) 0.0589(2) 0.0246(9) Uani 1 1 d .
C30 C 0.8601(4) 0.8769(3) -0.0404(2) 0.0274(10) Uani 1 1 d .
C31 C 0.9537(4) 1.0476(2) -0.0274(3) 0.0267(10) Uani 1 1 d .
O1 O 1.1758(3) 0.91554(17) 0.07534(14) 0.0243(6) Uani 1 1 d .
O2 O 0.5590(3) 1.0396(2) -0.08545(15) 0.0394(8) Uani 1 1 d .
O3 O 0.6910(4) 1.1236(2) 0.11806(17) 0.0453(8) Uani 1 1 d .
O4 O 0.5272(3) 0.8519(2) 0.07589(17) 0.0411(9) Uani 1 1 d .
O5 O 0.8959(4) 0.8233(2) -0.07625(18) 0.0435(9) Uani 1 1 d .
O6 O 1.0346(3) 1.0874(2) -0.05988(18) 0.0489(10) Uani 1 1 d .
P P 0.99658(10) 0.92974(6) 0.10393(5) 0.0178(2) Uani 1 1 d .
Mo Mo 0.79566(3) 0.97255(2) 0.021538(17) 0.01771(6) Uani 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 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 '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
O1 C1 C2 117.6(3)
O1 C1 P 60.92(17)
C2 C1 P 123.8(3)
O1 C1 H1 112(3)
C2 C1 H1 114(3)
P C1 H1 117(2)
C3 C2 C7 118.6(4)
C3 C2 C1 121.0(3)
C7 C2 C1 120.4(4)
C4 C3 C2 120.9(4)
C4 C3 H3A 119.6
C2 C3 H3A 119.6
C3 C4 C5 120.0(4)
C3 C4 H4A 120.0
C5 C4 H4A 120.0
C4 C5 C6 119.8(4)
C4 C5 H5A 120.1
C6 C5 H5A 120.1
C7 C6 C5 119.7(5)
C7 C6 H6A 120.2
C5 C6 H6A 120.2
C6 C7 C2 120.9(4)
C6 C7 H7A 119.5
C2 C7 H7A 119.5
C15 C8 C21 114.7(3)
C15 C8 C9 105.8(3)
C21 C8 C9 112.8(3)
C15 C8 P 112.4(3)
C21 C8 P 97.6(2)
C9 C8 P 113.8(2)
C14 C9 C10 118.1(3)
C14 C9 C8 122.0(3)
C10 C9 C8 119.5(3)
C11 C10 C9 120.2(4)
C11 C10 H10A 119.9
C9 C10 H10A 119.9
C12 C11 C10 120.7(4)
C12 C11 H11A 119.7
C10 C11 H11A 119.7
C11 C12 C13 120.0(4)
C11 C12 H12A 120.0
C13 C12 H12A 120.0
C12 C13 C14 119.9(4)
C12 C13 H13A 120.0
C14 C13 H13A 120.0
C9 C14 C13 121.1(4)
C9 C14 H14 119.5
C13 C14 H14 119.5
C16 C15 C20 117.7(4)
C16 C15 C8 123.3(4)
C20 C15 C8 118.7(4)
C17 C16 C15 121.2(4)
C17 C16 H16A 119.4
C15 C16 H16A 119.4
C18 C17 C16 120.6(4)
C18 C17 H17A 119.7
C16 C17 H17A 119.7
C17 C18 C19 119.1(4)
C17 C18 H18A 120.5
C19 C18 H18A 120.5
C18 C19 C20 120.8(4)
C18 C19 H19A 119.6
C20 C19 H19A 119.6
C19 C20 C15 120.5(4)
C19 C20 H20A 119.7
C15 C20 H20A 119.7
C22 C21 C26 117.7(3)
C22 C21 C8 120.6(3)
C26 C21 C8 121.4(3)
C23 C22 C21 121.6(4)
C23 C22 H22A 119.2
C21 C22 H22A 119.2
C22 C23 C24 120.6(4)
C22 C23 H23A 119.7
C24 C23 H23A 119.7
C23 C24 C25 118.7(4)
C23 C24 H24A 120.7
C25 C24 H24A 120.7
C24 C25 C26 121.5(3)
C24 C25 H25A 119.3
C26 C25 H25A 119.3
C25 C26 C21 119.9(4)
C25 C26 H26A 120.1
C21 C26 H26A 120.1
O2 C27 Mo 178.8(4)
O3 C28 Mo 177.9(4)
O4 C29 Mo 175.3(4)
O5 C30 Mo 179.0(4)
O6 C31 Mo 173.7(4)
C1 O1 P 68.93(16)
O1 P C1 50.16(14)
O1 P C8 110.82(14)
C1 P C8 105.61(17)
O1 P Mo 117.36(11)
C1 P Mo 125.28(14)
C8 P Mo 124.80(10)
C27 Mo C30 90.56(17)
C27 Mo C29 88.67(15)
C30 Mo C29 88.63(17)
C27 Mo C31 85.72(15)
C30 Mo C31 87.20(17)
C29 Mo C31 172.97(19)
C27 Mo C28 89.55(15)
C30 Mo C28 179.88(18)
C29 Mo C28 91.42(16)
C31 Mo C28 92.76(17)
C27 Mo P 175.72(12)
C30 Mo P 90.66(11)
C29 Mo P 95.46(11)
C31 Mo P 90.24(12)
C28 Mo P 89.23(11)
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
C1 O1 1.465(5)
C1 C2 1.487(5)
C1 P 1.781(3)
C1 H1 0.91(4)
C2 C3 1.385(6)
C2 C7 1.386(5)
C3 C4 1.368(6)
C3 H3A 0.9500
C4 C5 1.379(6)
C4 H4A 0.9500
C5 C6 1.388(6)
C5 H5A 0.9500
C6 C7 1.369(6)
C6 H6A 0.9500
C7 H7A 0.9500
C8 C15 1.534(5)
C8 C21 1.553(5)
C8 C9 1.556(5)
C8 P 1.892(4)
C9 C14 1.372(6)
C9 C10 1.407(5)
C10 C11 1.387(5)
C10 H10A 0.9500
C11 C12 1.357(6)
C11 H11A 0.9500
C12 C13 1.381(5)
C12 H12A 0.9500
C13 C14 1.391(5)
C13 H13A 0.9500
C14 H14 0.9500
C15 C16 1.384(6)
C15 C20 1.403(5)
C16 C17 1.380(5)
C16 H16A 0.9500
C17 C18 1.375(6)
C17 H17A 0.9500
C18 C19 1.377(6)
C18 H18A 0.9500
C19 C20 1.381(6)
C19 H19A 0.9500
C20 H20A 0.9500
C21 C22 1.393(5)
C21 C26 1.404(5)
C22 C23 1.374(5)
C22 H22A 0.9500
C23 C24 1.378(5)
C23 H23A 0.9500
C24 C25 1.383(6)
C24 H24A 0.9500
C25 C26 1.384(5)
C25 H25A 0.9500
C26 H26A 0.9500
C27 O2 1.145(4)
C27 Mo 1.996(4)
C28 O3 1.136(5)
C28 Mo 2.052(4)
C29 O4 1.145(4)
C29 Mo 2.044(4)
C30 O5 1.148(5)
C30 Mo 2.024(5)
C31 O6 1.141(5)
C31 Mo 2.052(4)
O1 P 1.668(2)
P Mo 2.4864(10)
loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
O1 C1 C2 C3 144.0(3)
P C1 C2 C3 72.1(5)
O1 C1 C2 C7 -37.7(5)
P C1 C2 C7 -109.6(4)
C7 C2 C3 C4 0.3(6)
C1 C2 C3 C4 178.6(4)
C2 C3 C4 C5 -0.8(7)
C3 C4 C5 C6 0.8(7)
C4 C5 C6 C7 -0.2(7)
C5 C6 C7 C2 -0.4(7)
C3 C2 C7 C6 0.4(7)
C1 C2 C7 C6 -178.0(4)
C15 C8 C9 C14 -107.3(4)
C21 C8 C9 C14 18.9(5)
P C8 C9 C14 128.8(4)
C15 C8 C9 C10 66.2(4)
C21 C8 C9 C10 -167.7(3)
P C8 C9 C10 -57.7(4)
C14 C9 C10 C11 -2.6(6)
C8 C9 C10 C11 -176.3(3)
C9 C10 C11 C12 2.3(6)
C10 C11 C12 C13 -0.7(6)
C11 C12 C13 C14 -0.6(6)
C10 C9 C14 C13 1.4(6)
C8 C9 C14 C13 174.9(4)
C12 C13 C14 C9 0.2(6)
C21 C8 C15 C16 132.1(4)
C9 C8 C15 C16 -103.0(4)
P C8 C15 C16 21.8(4)
C21 C8 C15 C20 -54.8(4)
C9 C8 C15 C20 70.2(4)
P C8 C15 C20 -165.0(2)
C20 C15 C16 C17 2.9(5)
C8 C15 C16 C17 176.1(3)
C15 C16 C17 C18 -1.5(6)
C16 C17 C18 C19 0.1(6)
C17 C18 C19 C20 -0.2(5)
C18 C19 C20 C15 1.7(5)
C16 C15 C20 C19 -3.0(5)
C8 C15 C20 C19 -176.5(3)
C15 C8 C21 C22 171.6(3)
C9 C8 C21 C22 50.4(5)
P C8 C21 C22 -69.5(4)
C15 C8 C21 C26 -14.4(5)
C9 C8 C21 C26 -135.7(4)
P C8 C21 C26 104.5(4)
C26 C21 C22 C23 2.3(6)
C8 C21 C22 C23 176.5(4)
C21 C22 C23 C24 -1.5(6)
C22 C23 C24 C25 1.2(6)
C23 C24 C25 C26 -1.8(7)
C24 C25 C26 C21 2.7(6)
C22 C21 C26 C25 -2.9(6)
C8 C21 C26 C25 -177.0(4)
C2 C1 O1 P -115.3(3)
C1 O1 P C8 -93.3(2)
C1 O1 P Mo 114.54(19)
C2 C1 P O1 105.4(4)
O1 C1 P C8 104.3(2)
C2 C1 P C8 -150.2(3)
O1 C1 P Mo -98.21(19)
C2 C1 P Mo 7.2(4)
C15 C8 P O1 -93.6(2)
C21 C8 P O1 145.7(2)
C9 C8 P O1 26.6(3)
C15 C8 P C1 -146.4(2)
C21 C8 P C1 93.0(2)
C9 C8 P C1 -26.1(3)
C15 C8 P Mo 56.0(3)
C21 C8 P Mo -64.6(2)
C9 C8 P Mo 176.3(2)
O2 C27 Mo C30 -109(19)
O2 C27 Mo C29 162(19)
O2 C27 Mo C31 -22(19)
O2 C27 Mo C28 71(19)
O2 C27 Mo P -3(20)
O5 C30 Mo C27 22(23)
O5 C30 Mo C29 111(23)
O5 C30 Mo C31 -63(23)
O5 C30 Mo C28 -134(100)
O5 C30 Mo P -154(23)
O4 C29 Mo C27 16(5)
O4 C29 Mo C30 -75(5)
O4 C29 Mo C31 -21(6)
O4 C29 Mo C28 106(5)
O4 C29 Mo P -165(5)
O6 C31 Mo C27 -35(3)
O6 C31 Mo C30 56(3)
O6 C31 Mo C29 2(4)
O6 C31 Mo C28 -124(3)
O6 C31 Mo P 146(3)
O3 C28 Mo C27 14(11)
O3 C28 Mo C30 170(100)
O3 C28 Mo C29 -74(11)
O3 C28 Mo C31 100(11)
O3 C28 Mo P -170(11)
O1 P Mo C27 -56.4(16)
C1 P Mo C27 2.4(17)
C8 P Mo C27 155.7(16)
O1 P Mo C30 50.07(17)
C1 P Mo C30 108.90(19)
C8 P Mo C30 -97.82(19)
O1 P Mo C29 138.75(17)
C1 P Mo C29 -162.4(2)
C8 P Mo C29 -9.1(2)
O1 P Mo C31 -37.13(17)
C1 P Mo C31 21.7(2)
C8 P Mo C31 174.98(19)
O1 P Mo C28 -129.89(16)
C1 P Mo C28 -71.06(19)
C8 P Mo C28 82.22(19)
