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#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: svn://www.crystallography.net/cod/cif/2/00/04/2000426.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_2000426
loop_
_publ_author_name
'Levason, W.'
'Webster, M.'
'Mitchell, C. J.'
_publ_section_title
;
 Structure of trans-diiodobis(methyl phenyl
 telluride)platinum(II)
;
_journal_issue                   11
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first              1931
_journal_page_last               1933
_journal_paper_doi               10.1107/S0108270192003354
_journal_volume                  48
_journal_year                    1992
_chemical_formula_sum            'C14 H16 I2 Pt Te2'
_chemical_formula_weight         888.37
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_H-M   'I 1 2/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 136.48(2)
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   23.807(6)
_cell_length_b                   9.5480(10)
_cell_length_c                   24.192(6)
_cell_volume                     3787(2)
_diffrn_radiation_type           Mo
_diffrn_radiation_wavelength     0.71069
_exptl_absorpt_coefficient_mu    13.72
_exptl_crystal_density_diffrn    3.116
_exptl_crystal_density_meas      3.04(2)
_exptl_crystal_F_000             3104
_cod_data_source_file            mu0295.cif
_cod_data_source_block           mu0295a
_cod_original_cell_volume        3786.7
_cod_original_sg_symbol_H-M      'I 2/a'
_cod_original_formula_sum        'C14 H16 I2 Pt1 Te2'
_cod_database_code               2000426
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
Pt(1) .26473(2) .46961(5) .07865(2) .03790(10)
I(1) .16866(5) .25568(9) .02490(5) .0572(5)
I(2) .36353(5) .68235(9) .14044(5) .0564(4)
Te(1) .13821(5) .61957(9) .01082(5) .0565(4)
Te(2) .39783(5) .32424(9) .17329(5) .0513(3)
C(1) .1453(7) .6068(12) .1044(6) .050(5)
C(2) .2152(7) .5707(15) .1804(6) .065(7)
C(3) .2201(9) .5759(14) .2421(8) .069(7)
C(4) .1508(10) .6144(14) .2226(8) .074(8)
C(5) .0818(12) .6443(18) .1455(12) .107(12)
C(6) .0782(10) .6429(18) .0853(9) .093(10)
C(7) .1669(11) .8343(17) .0314(9) .092(10)
C(8) .4136(7) .3443(13) .2732(6) .053(6)
C(9) .4588(8) .4541(17) .3237(7) .076(8)
C(10) .4616(9) .4714(18) .3829(8) .096(10)
C(11) .4267(8) .3909(17) .3936(7) .072(8)
C(12) .3793(10) .2826(18) .3415(9) .094(10)
C(13) .3749(10) .2593(17) .2793(8) .084(9)
C(14) .3693(9) .1077(15) .1552(8) .074(7)
H(2) .2612 .5417 .1923 ?
H(3) .2696 .5537 .2959 ?
H(4) .1523 .6195 .2629 ?
H(5) .0339 .6670 .1316 ?
H(6) .0292 .6671 .0317 ?
H(7A) .1690 .8723 -.0038 ?
H(7B) .2207 .8510 .0861 ?
H(7C) .1288 .8883 .0252 ?
H(9) .4867 .5152 .3190 ?
H(10) .4918 .5487 .4183 ?
H(11) .4338 .4066 .4372 ?
H(12) .3502 .2247 .3458 ?
H(13) .3443 .1830 .2432 ?
H(14A) .3590 .0721 .1114 ?
H(14B) .3210 .0909 .1425 ?
H(14C) .4128 .0545 .2021 ?
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
I(1) Pt(1) I(2) 176.60(10)
Te(1) Pt(1) Te(2) 167.80(10)
I(1) Pt(1) Te(1) 85.40(10)
Pt(1) Te(1) C(1) 97.7(3)
Pt(1) Te(1) C(7) 111.2(5)
C(1) Te(1) C(7) 92.4(5)
Te(1) C(1) C(2) 121.7(9)
Te(1) C(1) C(6) 117.2(9)
I(1) Pt(1) Te(2) 95.10(10)
I(2) Pt(1) Te(1) 94.80(10)
I(2) Pt(1) Te(2) 83.90(10)
Pt(1) Te(2) C(8) 92.9(3)
Pt(1) Te(2) C(14) 109.7(4)
C(8) Te(2) C(14) 95.0(5)
Te(2) C(8) C(9) 117.1(10)
Te(2) C(8) C(13) 120.2(10)
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
Pt(1) I(1) 2.6040(10)
Pt(1) I(2) 2.6070(10)
Te(1) C(1) 2.150(10)
Te(1) C(7) 2.10(2)
C(1) C(2) 1.350(10)
C(2) C(3) 1.41(2)
C(3) C(4) 1.40(2)
C(4) C(5) 1.35(2)
C(5) C(6) 1.40(2)
C(6) C(1) 1.35(2)
Pt(1) Te(1) 2.5780(10)
Pt(1) Te(2) 2.5860(10)
Te(2) C(8) 2.170(10)
Te(2) C(14) 2.12(2)
C(8) C(9) 1.36(2)
C(9) C(10) 1.39(2)
C(10) C(11) 1.29(2)
C(11) C(12) 1.37(2)
C(12) C(13) 1.45(2)
C(13) C(8) 1.31(2)
