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#$Date: 2008-01-14 00:15:36 +0200 (Mon, 14 Jan 2008) $
#$Revision: 14 $
#$URL: file:///home/coder/svn-repositories/cod/cif/2/2001976.cif $
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#
# 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_2001976
_journal_name_full 'Acta Crystallographica, Section C'
_journal_year 1993
_journal_volume C49
_journal_page_first 327
_journal_page_last 328
loop_
_publ_author_name
'Bachman, R.E.'
'Whitmire, K.H.'
_chemical_formula_moiety '2(C36 H30 N1 P2),C10 Mo2 O10'
_chemical_formula_sum 'C82 H60 Mo2 N2 O10 P4'
_chemical_formula_weight 1549.16
_symmetry_cell_setting triclinic
_symmetry_space_group_name_H-M 'P -1'
_symmetry_space_group_name_Hall '-P 1'
_cell_length_a 13.00(2)
_cell_length_b 15.420(3)
_cell_length_c 20.281(8)
_cell_angle_alpha 94.39(3)
_cell_angle_beta 89.91(4)
_cell_angle_gamma 114.65(4)
_cell_volume 3683
_cell_formula_units_Z 2
_exptl_crystal_density_diffrn 1.397
_exptl_crystal_density_meas ?
_exptl_crystal_F_000 1580.0
_exptl_absorpt_coefficient_mu 1.19
_diffrn_radiation_type Mo
_diffrn_radiation_wavelength 0.71069
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Mo(1) 0.03423(7) .12643(6) .74333(4)
Mo(2) -.07288(7) -.09895(6) .73926(4)
O(11) -.1838(7) .1114(7) .8199(4)
O(12) .1355(6) .1067(5) .8803(3)
O(13) .2441(6) .1045(5) .6758(3)
O(14) -.0978(7) .1007(5) .6066(4)
O(15) .1648(6) .3474(5) .7425(4)
O(21) -.3014(6) -.0926(6) .6907(4)
O(22) -.1403(7) -.0666(6) .8872(4)
O(23) .1786(6) -.0556(4) .7858(3)
O(24) .0094(6) -.0877(5) .5914(4)
O(25) -.1530(6) -.3189(5) .7455(4)
C(11) -.1070(10)
   .1166(8) .7929(6)
C(12) .0989(8) .1138(6) .8302(5)
C(13) .1669(9) .1110(7) .6968(5)
C(14) -.0485(9) .1092(7) .6560(5)
C(15) .1124(8) .2650(7) .7438(5)
C(21) -.2187(9) -.0949(7) .7077(5)
C(22) -.1154(8) -.0783(7) .8333(6)
C(23) .0872(9) -.0720(6) .7691(4)
C(24) -.0207(8) -.0928(7) .6454(5)
C(25) -.1248(8) -.2367(8) .7428(5)