data_2000543
_journal_name_full  'Acta Cryst.'
_journal_year  1992
_journal_volume  C48
_journal_page_first  1843
_journal_page_last  1844
loop_
_publ_author_name
 'Herbst-Irmer, R.'
 'Egert, E.'
_chemical_formula_moiety  '2(C2 H4 F3 N2),Cl8 Mo2 O2'
_chemical_formula_sum  'C4 H8 Cl8 F6 Mo2 N4 O2'
_chemical_formula_weight  733.6
_symmetry_cell_setting  triclinic
_symmetry_space_group_name_H-M  'P -1'
_symmetry_space_group_name_Hall  '-P 1'
_cell_length_a  6.7010(10)
_cell_length_b  8.6740(10)
_cell_length_c  9.1790(10)
_cell_angle_alpha  83.500(10)
_cell_angle_beta  89.370(10)
_cell_angle_gamma  74.350(10)
_cell_volume  510.30(10)
_cell_formula_units_Z  1
_exptl_crystal_density_diffrn  2.387
_exptl_crystal_density_meas  ?
_exptl_crystal_F_000  350
_exptl_absorpt_coefficient_mu  2.32
_diffrn_radiation_type  Mo
_diffrn_radiation_wavelength  0.7107
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
 Mo .09790(10)
    .28400(10)
       .14140(10)
          .0260(10)
 Cl(1) .11480(10)
       .16260(10)
       -.07950(10)
           .0340(10)
 Cl(2) .45660(10)
       .17860(10)
       .16190(10)
          .0400(10)
 Cl(3) -.22470(10)
     .47050(10)
        .05480(10)
           .0300(10)
 Cl(4) .12070(10)
       .45750(10)
       .31830(10)
          .0380(10)
 O .0105(3) .1515(2) .2461(2) .0440(10)
 C(1) .4452(4) .7590(3) .3237(3) .0310(10)
 C(2) .2943(4) .7928(3) .4485(3) .0340(10)
 N(1) .3710(4) .7874(3) .1908(3) .0430(10)
 N(1') .6401(4) .7070(4) .3606(3) .0500(10)
 F(2) .1009(2) .8159(2) .4045(2) .0480(10)
 F(2') .3386(3) .6714(2) .5544(2) .0550(10)
 F(2") .3082(3) .9241(2) .5030(2) .0580(10)
 H(1a) .468(4)   .765(4)   .118(3)   ?
 H(1b) .2275(6) .812(4)   .182(4)   ?
 H(1'a) .734(4)   .698(4)   .285(3)   ?
 H(1'b) .676(5)   .675(4)   .4590(10) ?