#------------------------------------------------------------------------------
#$Date: 2016-02-19 16:29:56 +0200 (Fri, 19 Feb 2016) $
#$Revision: 176759 $
#$URL: svn://www.crystallography.net/cod/cif/2/00/10/2001059.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2001059
loop_
_publ_author_name
'van Bolhuis, F.'
'Meetsma, A.'
'van de Grampel, J. C.'
'Brandt, K.'
_publ_section_title
;Structure of
 2,2'-(2,4-pyrimidinediyldioxy)bis(2,4,4,6,6-pentachloro-1,3,5,2λ⁵,4λ⁵,6λ⁵-triazatriphosphorine)
 at 130 K
;
_journal_issue                   2
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first              337
_journal_page_last               339
_journal_paper_doi               10.1107/S0108270191009447
_journal_volume                  48
_journal_year                    1992
_chemical_formula_sum            'C4 H2 Cl10 N8 O2 P6'
_chemical_formula_weight         734.48
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yab'
_symmetry_space_group_name_H-M   'P 1 21/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 107.70(5)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.365(8)
_cell_length_b                   22.654(2)
_cell_length_c                   13.436(5)
_cell_volume                     2426(3)
_diffrn_radiation_type           Mo
_diffrn_radiation_wavelength     0.71073
_exptl_absorpt_coefficient_mu    1.57
_exptl_crystal_density_diffrn    2.011
_exptl_crystal_F_000             1432
_cod_data_source_file            ge0272.cif
_cod_data_source_block           ge0272a
_cod_database_code               2001059
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
Cl(1) .45080(10) .28799(4) .77528(6) .0259(3)
Cl(2) .72440(10) .49812(4) 1.01678(6) .0207(2)
Cl(3) .59450(10) .39584(4) 1.12325(6) .0235(3)
Cl(4) .99990(10) .26041(4) 1.06577(7) .0270(3)
Cl(5) 1.15040(10) .35540(4) .95634(7) .0290(3)
Cl(6) .71800(10) .52193(4) .29846(6) .0202(2)
Cl(7) .32240(10) .34588(4) .24650(6) .0237(3)
Cl(8) .36460(10) .35277(4) .48131(6) .0237(3)
Cl(9) .97180(10) .31670(5) .56218(8) .0385(3)
Cl(10) .93040(10) .30926(4) .32620(8) .0315(3)
P(1) .62800(10) .34790(4) .82841(6) .0149(2)
P(2) .70130(10) .41044(4) 1.01135(6) .0149(2)
P(3) .93370(10) .33352(4) .97920(7) .0170(2)
P(4) .71100(10) .46249(4) .40558(6) .0136(2)
P(5) .49180(10) .36914(4) .38160(6) .0163(2)
P(6) .82970(10) .34826(4) .42525(7) .0185(2)
O(1) .6145(3) .37770(10) .7184(2) .0182(6)
O(2) .7562(3) .50730(10) .5026(2) .0177(6)
N(1) .6944(3) .43970(10) .6122(2) .0148(6)
N(2) .7928(3) .45340(10) .7973(2) .0186(8)
N(3) .5711(3) .39040(10) .9045(2) .0162(6)
N(4) .8840(4) .38290(10) 1.0474(2) .0196(8)
N(5) .8033(4) .31630(10) .8713(2) .0212(10)
N(6) .5262(3) .43760(10) .3768(2) .0158(6)
N(7) .6445(4) .32520(10) .4035(3) .0253(12)
N(8) .8596(3) .41690(10) .4219(2) .0166(6)
C(1) .7076(4) .42630(10) .7108(3) .0164(12)
C(2) .8711(4) .5027(2) .7817(3) .0187(12)
C(3) .8658(4) .52330(10) .6850(3) .0167(12)
C(4) .7726(4) .48880(10) .6026(2) .0152(12)
H(2) .923(5) .524(2) .836(3) .025(8)
H(3) .921(4) .558(2) .674(3) .017(9)
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
P(1) N(3) 1.579(3)
P(1) N(5) 1.575(4)
P(2) N(3) 1.582(3)
P(2) N(4) 1.584(4)
P(3) N(4) 1.580(3)
P(3) N(5) 1.575(3)
P(4) N(6) 1.579(3)
P(4) N(8) 1.579(3)
P(5) N(6) 1.582(3)
P(5) N(7) 1.575(4)
P(6) N(7) 1.576(4)
P(6) N(8) 1.578(3)
Cl(1) P(1) 1.976(2)
Cl(2) P(2) 1.995(2)
Cl(3) P(2) 1.996(2)
Cl(4) P(3) 2.003(2)
Cl(5) P(3) 1.991(2)
Cl(6) P(4) 1.985(2)
Cl(7) P(5) 2.004(2)
Cl(8) P(5) 1.983(2)
Cl(9) P(6) 1.995(2)
Cl(10) P(6) 1.988(2)
P(1) O(1) 1.597(3)
P(4) O(2) 1.604(3)
O(1) C(1) 1.370(4)
O(2) C(4) 1.374(4)
N(1) C(1) 1.331(4)
N(2) C(2) 1.343(5)
N(1) C(4) 1.316(4)
N(2) C(1) 1.316(5)
C(2) C(3) 1.369(6)
C(3) C(4) 1.385(4)
C(2) H(2) 0.87(4)
C(3) H(3) 0.95(4)
