data_2000191
_journal_name_full 'Acta Cryst. C'
_journal_year   1991
_journal_volume  47
_journal_page_first  2472
_journal_page_last  2474
loop_
_publ_author_name
 'Britton, D.'
_chemical_formula_sum  'C8 Cl1 F3 N2'
_chemical_formula_weight  216.55
_symmetry_cell_setting  monoclinic
_symmetry_space_group_name_H-M  'P 1 21/c 1'
_symmetry_space_group_name_Hall  '-P 2ybc'
_cell_length_a  10.266(3)
_cell_length_b  14.848(6)
_cell_length_c  11.537(3)
_cell_angle_alpha  90
_cell_angle_beta  108.83(3)
_cell_angle_gamma  90
_cell_volume  1664(2)
_cell_formula_units_Z  8
_exptl_crystal_density_diffrn  1.728(2)
_exptl_crystal_density_meas  ?
_exptl_crystal_F_000  848
_exptl_absorpt_coefficient_mu  0.460
_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
 C1A .8122(3) .3335(3) .4829(3)
 C2A .7432(3) .3059(2) .5618(3)
 C3A .6775(3) .3655(3) .6151(3)
 C4A .6827(3) .4555(3) .5874(3)
 C5A .7512(3) .4872(2) .5104(3)
 C6A .8140(3) .4245(3) .4604(3)
 C11A .8816(4) .2704(3) .4278(4)
 N1A .9359(4) .2224(3) .3845(4)
 F2A .7424(2) .21850(10)  .5877(2)
 C13A .6049(4) .3356(3) .6970(4)
 N3A .5488(4) .3126(3) .7587(4)
 F4A .6171(2) .5148(2) .6362(2)
 Cl5A .75690(10)   .59955(8) .47930(10)
 F6A .8834(2) .45220(10)  .38710(10)
 C1B .6363(3) .9100(2) .4803(3)
 C2B .6493(3) .8376(2) .5574(3)
 C3B .7600(3) .8280(2) .6622(3)
 C4B .8613(3) .8941(2) .6877(3)
 C5B .8558(3) .9667(2) .6124(3)
 C6B .7419(3) .9729(2) .5096(3)
 C11B .5177(4) .9215(3) .3731(3)
 N1B .4222(4) .9322(3) .2921(3)
 F2B .5529(2) .77430(10)  .5289(2)
 C13B .7727(4) .7525(3) .7428(3)
 N3B .7853(4) .6941(3) .8086(4)
 F4B .9682(2) .88580(10)  .7893(2)
 Cl5B .98390(10)   1.04481(7) .64540(10)
 F6B .7304(2) 1.0427(2) .4349(2)