#------------------------------------------------------------------------------
#$Date: 2011-09-28 15:24:46 +0100 (Wed, 28 Sep 2011) $
#$Revision: 26848 $
#$URL: svn://www.crystallography.net/cod/cif/2/00/55/2005505.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_2005505
_journal_name_full               'Acta Crystallographica C'
_journal_volume                  52
_journal_year       1996
_journal_page_first    	2396
_journal_page_last    	2399
_publ_section_title
;
Derivatives of Bis(diphenylphosphino)difluoromethane: the Disulfide
Ph~2~P(=S)CF~2~P(=S)Ph~2~ and the Bis[chlorogold(I)] Complex
Ph~2~P(AuCl)CF~2~P(AuCl)Ph~2~
;
_chemical_formula_iupac    	'C25 H20 F2 P2 S2'
_chemical_formula_sum    	'C25 H20 F2 P2 S2'
_chemical_formula_weight    	484.47
_symmetry_cell_setting    	triclinic
loop_
_symmetry_equiv_pos_as_xyz
    'x, y, z'
    '-x, -y, -z'
_symmetry_space_group_name_H-M    	'P -1'
_cell_length_a    	9.519(3)
_cell_length_b    	11.446(4)
_cell_length_c    	11.650(4)
_cell_angle_alpha    	108.67(3)
_cell_angle_beta    	104.86(3)
_cell_angle_gamma    	94.68(3)
_cell_volume    	1143.6(7)
_cell_formula_units_Z    	2
_exptl_crystal_density_diffrn    	1.407
_cell_measurement_temperature    	178(2)
loop_
_atom_site_label
_atom_site_occupancy
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
    P1 1 0.72888(7) 0.20127(6) 0.43075(6) 0.03212(17)
    P2 1 0.62214(7) 0.32679(6) 0.21890(6) 0.03414(18)
    S1 1 0.55388(7) 0.07266(6) 0.34478(7) 0.0456(2)
    S2 1 0.73387(9) 0.22322(7) 0.12384(7) 0.0522(2)
    F1 1 0.81697(17) 0.43775(12) 0.44772(14) 0.0475(4)
    F2 1 0.59118(17) 0.39359(14) 0.45317(13) 0.0470(4)
    C1 1 0.6917(3) 0.3468(2) 0.3928(2) 0.0362(5)
    C11 1 0.8952(3) 0.1581(2) 0.3938(2) 0.0332(5)
    C12 1 0.8974(3) 0.0310(2) 0.3506(3) 0.0473(7)
    H12 1 0.8134 -0.0271 0.3394 0.057
    C13 1 1.0212(4) -0.0122(3) 0.3235(3) 0.0605(8)
    H13 1 1.0218 -0.0996 0.2938 0.073
    C14 1 1.1414(3) 0.0700(3) 0.3391(3) 0.0572(8)
    H14 1 1.2256 0.0400 0.3194 0.069
    C15 1 1.1417(3) 0.1964(3) 0.3832(3) 0.0565(8)
    H15 1 1.2269 0.2534 0.3947 0.068
    C16 1 1.0196(3) 0.2422(3) 0.4111(3) 0.0497(7)
    H16 1 1.0207 0.3299 0.4417 0.060
    C21 1 0.7765(3) 0.2589(2) 0.6033(2) 0.0358(5)
    C22 1 0.6902(3) 0.2048(2) 0.6579(3) 0.0446(6)
    H22 1 0.6042 0.1444 0.6055 0.053
    C23 1 0.7282(3) 0.2380(3) 0.7890(3) 0.0533(7)
    H23 1 0.6687 0.1999 0.8261 0.064
    C24 1 0.8511(3) 0.3254(3) 0.8644(3) 0.0537(8)
    H24 1 0.8772 0.3477 0.9540 0.064
    C25 1 0.9382(3) 0.3818(3) 0.8115(3) 0.0568(8)
    H25 1 1.0226 0.4436 0.8648 0.068
    C26 1 0.9023(3) 0.3481(3) 0.6807(3) 0.0482(7)
    H26 1 0.9630 0.3856 0.6440 0.058
    C31 1 0.4246(3) 0.2697(2) 0.1655(2) 0.0366(6)
    C32 1 0.3263(3) 0.3451(3) 0.2056(3) 0.0443(6)
    H32 1 0.3627 0.4263 0.2685 0.053
    C33 1 0.1753(3) 0.3018(3) 0.1536(3) 0.0561(8)
    H33 1 0.1084 0.3528 0.1822 0.067
    C34 1 0.1225(3) 0.1853(3) 0.0610(3) 0.0595(8)
    H34 1 0.0190 0.1564 0.0249 0.071
    C35 1 0.2176(4) 0.1107(3) 0.0204(3) 0.0588(8)
    H35 1 0.1799 0.0303 -0.0437 0.071
    C36 1 0.3697(3) 0.1517(2) 0.0723(3) 0.0470(7)
    H36 1 0.4356 0.0993 0.0442 0.056
    C41 1 0.6422(3) 0.4865(2) 0.2200(2) 0.0378(6)
    C42 1 0.6272(3) 0.5898(2) 0.3160(3) 0.0523(7)
    H42 1 0.6109 0.5807 0.3900 0.063
    C43 1 0.6364(4) 0.7068(3) 0.3029(3) 0.0614(8)
    H43 1 0.6277 0.7778 0.3690 0.074
    C44 1 0.6578(3) 0.7202(3) 0.1956(3) 0.0611(9)
    H44 1 0.6620 0.8000 0.1868 0.073
    C45 1 0.6732(3) 0.6196(3) 0.1017(3) 0.0553(8)
    H45 1 0.6888 0.6294 0.0278 0.066
    C46 1 0.6663(3) 0.5027(3) 0.1133(3) 0.0451(6)
    H46 1 0.6782 0.4331 0.0476 0.054
_cod_database_code 2005505