#------------------------------------------------------------------------------
#$Date: 2008-01-14 00:15:36 +0200 (Mon, 14 Jan 2008) $
#$Revision: 14 $
#$URL: file:///home/coder/svn-repositories/cod/cif/2/2005701.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_2005701
_journal_name_full  'Acta Crystallographica'
_journal_year       1996
_journal_volume    	C52
_journal_page_first    	3243
_journal_page_last    	3246
_publ_section_title    	
;
2-(2,6-Di-tert-butyl-4-methylphenoxy)-2,4,4,6,6,8,8-heptachlorocyclo-
2\l^5^,4\l^5^,6\l^5^,8\l^5^-tetraphosphazatetraene
;
_chemical_formula_moiety    	'C15 H23 Cl7 N4 O P4'
_chemical_formula_sum    	'C15 H23 Cl7 N4 O P4'
_chemical_formula_weight    	647.44
_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    	10.029(1)
_cell_length_b    	11.051(1)
_cell_length_c    	13.794(1)
_cell_angle_alpha    	71.81(1)
_cell_angle_beta    	73.87(1)
_cell_angle_gamma    	73.61(1)
_cell_volume    	1362.9(2)
_cell_formula_units_Z    	2
_exptl_crystal_density_diffrn    	1.58
_cell_measurement_temperature    	298
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_B_iso_or_equiv
    Cl1 0.58375(8) 0.14609(7) 0.46530(5) 3.78(2)
    Cl2 0.6461(1) 0.3756(1) 0.58563(6) 5.77(2)
    Cl3 0.7487(1) 0.59697(7) 0.40062(7) 6.24(2)
    Cl4 1.1682(1) 0.44481(8) 0.33030(7) 6.45(2)
    Cl5 1.18970(8) 0.17085(8) 0.48399(6) 4.62(2)
    Cl6 1.07089(9) 0.15088(8) 0.12765(6) 4.79(2)
    Cl7 1.10915(8) -0.03670(7) 0.34389(7) 4.69(2)
    P1 0.70661(6) 0.24300(6) 0.34131(5) 2.31(1)
    P2 0.77059(8) 0.40480(7) 0.44408(5) 3.16(2)
    P3 1.06830(7) 0.29832(7) 0.38954(5) 2.97(1)
    P4 1.01065(7) 0.14277(6) 0.27937(5) 2.60(1)
    O1 0.6152(2) 0.2798(2) 0.2560(1) 2.43(4)
    N1 0.7092(2) 0.3706(2) 0.3664(2) 3.20(5)
    N2 0.9234(3) 0.3380(2) 0.4627(2) 4.15(6)
    N3 1.0752(2) 0.2472(2) 0.2945(2) 3.17(5)
    N4 0.8494(2) 0.1455(2) 0.3146(2) 3.02(5)
    C1 0.6736(2) 0.2731(2) 0.1500(2) 2.35(5)
    C2 0.7160(3) 0.3832(2) 0.0769(2) 2.56(5)
    C3 0.7944(3) 0.3630(3) -0.0195(2) 3.55(7)
    C4 0.8207(3) 0.2467(3) -0.0447(2) 4.00(8)
    C5 0.7576(3) 0.1485(3) 0.0256(2) 3.67(7)
    C6 0.6786(3) 0.1579(2) 0.1245(2) 2.72(6)
    C7 0.6819(3) 0.5227(2) 0.0913(2) 3.07(6)
    C8 0.5457(3) 0.5530(3) 0.1718(2) 3.98(7)
    C9 0.8093(3) 0.5465(3) 0.1187(2) 4.53(8)
    C10 0.6568(4) 0.6221(3) -0.0117(2) 4.91(9)
    C11 0.6001(3) 0.0492(2) 0.1932(2) 3.18(6)
    C12 0.4517(3) 0.1052(3) 0.2496(3) 4.20(8)
    C13 0.6835(3) -0.0500(3) 0.2723(2) 4.12(8)
    C14 0.5754(4) -0.0267(3) 0.1249(3) 6.03(9)
    C15 0.9123(5) 0.2268(4) -0.1493(3) 7.4(1)
    H3 0.830 0.437 -0.071 3.9(7)
    H5 0.769 0.070 0.005 4.7(7)
    H81 0.533 0.640 0.176 5.7(8)
    H82 0.466 0.545 0.152 7(1)
    H83 0.554 0.495 0.238 6.0(8)
    H91 0.786 0.632 0.127 8(1)
    H92 0.828 0.485 0.182 5.4(8)
    H93 0.891 0.537 0.064 6.5(9)
    H101 0.636 0.707 -0.002 6.4(9)
    H102 0.739 0.612 -0.065 5.1(8)
    H103 0.579 0.610 -0.031 6.0(9)
    H121 0.407 0.035 0.291 6.3(9)
    H122 0.458 0.154 0.293 7(1)
    H123 0.397 0.159 0.200 7(1)
    H131 0.631 -0.115 0.313 3.6(6)
    H132 0.772 -0.090 0.237 4.2(7)
    H133 0.699 -0.007 0.316 6.7(9)
    H141 0.527 -0.093 0.168 6.4(9)
    H142 0.521 0.031 0.076 10(1)
    H143 0.666 -0.064 0.089 6.3(9)
    H151 0.947 0.303 -0.189 15(2)
    H152 0.989 0.155 -0.136 11(1)
    H153 0.857 0.208 -0.186 12(2)