data_2000698
_journal_name_full  'Acta Cryst.'
_journal_year  1992
_journal_volume  C48
_journal_page_first  1491
_journal_page_last  1493
loop_
_publ_author_name
 'Preut, H.'
 'Godry, B.'
 'Mitchell, T.N.'
_chemical_formula_sum  'C16 H20 Br1 P1 S1 Sn1'
_chemical_formula_weight  473.96
_symmetry_cell_setting  orthorhombic
_symmetry_space_group_name_H-M  'P 21 21 21'
_symmetry_space_group_name_Hall  ?
_cell_length_a  10.535(2)
_cell_length_b  10.936(2)
_cell_length_c  16.500(3)
_cell_angle_alpha  90.
_cell_angle_beta  90.
_cell_angle_gamma  90.
_cell_volume  1901.0(6)
_cell_formula_units_Z  4
_exptl_crystal_density_diffrn  1.656
_exptl_crystal_density_meas  ?
_exptl_crystal_F_000  928
_exptl_absorpt_coefficient_mu  3.61
_diffrn_radiation_type  Mo
_diffrn_radiation_wavelength  0.71073
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
 Sn(1) .89397(4) .12253(3) .22944(2) .0559
 Br(1) 1.01974(9) .06600(8) .36342(4) .1110
 S(1) .77400(10)
      .1724(2) .07668(8) .0679
 P(1) .93840(10)
      .16900(10)
         .01907(7) .0465
 C(1) .8019(7) .2795(6) .2776(4) .0980
 C(2) .7936(6) -.0491(5) .2259(4) .0817
 C(3) 1.0684(4) .1455(5) .1625(3) .0548
 C(4) 1.0631(5) .2195(5) .0855(3) .0505
 C(11) .9354(4) .2669(5) -.0697(3) .0484
 C(12) .9427(6) .2182(6) -.1469(3) .0685
 C(13) .9342(6) .2923(6) -.2129(3) .0757
 C(14) .9205(6) .4160(6) -.2036(3) .0728
 C(15) .9113(7) .4646(6) -.1290(4) .0753
 C(16) .9212(5) .3902(5) -.0608(3) .0651
 C(21) .9817(5) .0172(5) -.0135(3) .0533
 C(22) .8982(7) -.0794(6) -.0089(4) .0819
 C(23) .9370(10)
      -.1947(7) -.0304(5) .1021
 C(24) 1.0560(10)
       -.2151(7) -.0555(4) .0959
 C(25) 1.1402(6) -.1221(7) -.0635(4) .0808
 C(26) 1.1040(6) -.0055(6) -.0425(4) .0689
 H(1a) .8246(7) .2899(6) .3335(4) ?
 H(1b) .7115(7) .2702(6) .2731(4) ?
 H(1c) .8284(7) .3499(6) .2472(4) ?
 H(2a) .8149(6) -.0948(5) .2737(4) ?
 H(2b) .8190(6) -.0943(5) .1788(4) ?
 H(2c) .7036(6) -.0355(5) .2244(4) ?
 H(3a) 1.1291(4) .1827(5) .1982(3) ?
 H(3b) 1.1002(4) .0660(5) .1486(3) ?
 H(4a) 1.1427(5) .2149(5) .0574(3) ?
 H(4b) 1.0479(5) .3035(5) .0993(3) ?
 H(12a) .9510(6) .1312(6) -.1525(3) ?
 H(13a) .9399(6) .2586(6) -.2665(3) ?
 H(14a) .9173(6) .4684(6) -.2503(3) ?
 H(15a) .8978(7) .5509(6) -.1223(4) ?
 H(16a) .9176(5) .4238(5) -.0071(3) ?
 H(22a) .8130(7) -.0646(6) .0093(4) ?
 H(23a) .8790(10)
       -.2620(7) -.0279(5) ?
 H(24a) 1.0830(10)
     -.2969(7) -.0677(4) ?
 H(25a) 1.2241(6) -.1377(7) -.0839(4) ?
 H(26a) 1.1633(6) .0608(6) -.0467(4) ?