data_2000251
_journal_name_full 'Acta Cryst. C'
_journal_year   1991
_journal_volume  47
_journal_page_first  1888
_journal_page_last  1892
loop_
_publ_author_name
 'Branes, J.C.'
 'Paton, J.D.'
 'Blyth, C.S.'
_chemical_formula_sum  'C10 H20 N1 O5'
_symmetry_cell_setting  trigonal
_symmetry_space_group_name_H-M  'P 32'
_symmetry_space_group_name_Hall  ?
_cell_length_a  13.013(5)
_cell_length_b  13.013(5)
_cell_length_c  6.326(7)
_cell_angle_alpha  90
_cell_angle_beta  90
_cell_angle_gamma  120
_cell_volume  927.71
_cell_formula_units_Z  3
_exptl_crystal_density_diffrn  1.26
_exptl_crystal_density_meas  ?
_exptl_crystal_F_000  381
_exptl_absorpt_coefficient_mu  .063
_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
_atom_site_U_iso_or_equiv
 C1 .7057(6) -.2617(7) .1471 .037(2)
 C2 .6316(6) -.1983(6) .0782(16) .037(2)
 C3 .7373(6) -.0736(6) .0197(16) .034(2)
 C4 .8301(8) -.0969(7) -.0870(17) .047(2)
 C5 .8040(7) -.2203(8) -.0161(17) .046(2)
 C6 .7588(7) -.2244(8) .3644(18) .053(3)
 C7 .6263(7) -.3977(7) .1498(17) .041(2)
 O8 .5379(6) -.4368(5) .2764(15) .061(2)
 O9 .6463(5) -.4634(5) .0429(15) .055(2)
 C10 .5530(7) -.2628(7) -.1111(18) .049(3)
 C11 .5551(8) -.1902(8) .2476(17) .051(3)
 C12 .6986(7) -.0002(7) -.1066(18) .041(2)
 O13 .6594(5) .0570(5) -.0083(15) .0440(10)
 O14 .7033(6) -.0022(6) -.3022(15) .066(2)
 N15 .6657(6) .1285(6) -.5929(16) .046(2)
 O16 .7209(6) .2960(5) -.0687(15) .068(2)
 H31 .7768 -.0182 .1569 ?
 H41 .9184 -.0306 -.0384 ?
 H42 .8230 -.0945 -.2568 ?
 H51 .8823 -.2153 .0531 ?
 H52 .7753 -.2805 -.1489 ?
 H61 .8154 -.1292 .3689 ?
 H62 .8105 -.2662 .4009 ?
 H63 .6886 -.2512 .4794 ?
 H101 .6064 -.2696 -.2350 ?
 H102 .5118 -.2139 -.1685 ?
 H103 .4852 -.3506 -.0638 ?
 H111 .6092 -.1447 .3834 ?
 H112 .4873 -.2784 .2929 ?
 H113 .5139 -.1416 .1882 ?
 H151 .6906 .0890 -.4721 ?
 H152 .7301 .1927 -.5448 ?
 H153 .5824 .1264 -.5705 ?
 H154 .6707 .1021 -.7528 ?