data_2000313
_journal_name_full 'Acta Cryst. C'
_journal_year   1991
_journal_volume  47
_journal_page_first  1345
_journal_page_last  1347
loop_
_publ_author_name
 'Lynch, V.M.'
 'Austin, R.E.'
 'Martin, S.F.'
 'George, T.'
_chemical_formula_sum  'C25 H35 N1 O4'
_symmetry_cell_setting  orthorhombic
_symmetry_space_group_name_H-M  'P212121'
_symmetry_space_group_name_Hall  ?
_cell_length_a  9.359(2)
_cell_length_b  10.1170(10)
_cell_length_c  24.710(4)
_cell_angle_alpha  90
_cell_angle_beta  90
_cell_angle_gamma  90
_cell_volume  2339.8(6)
_cell_formula_units_Z  4
_exptl_crystal_density_diffrn  1.17
_exptl_crystal_density_meas  ?
_exptl_crystal_F_000  896
_exptl_absorpt_coefficient_mu  0.0733
_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
 C1 .5344(3) .1830(3) .33725(10) .0359(7)
 C2 .4372(3) .3011(3) .33906(10) .0347(7)
 C3 .5279(3) .2759(2) .28912(10) .0342(7)
 C4 .6645(3) .1866(3) .37111(10) .0378(8)
 O5 .7417(2) .2811(2) .37637(8) .0531(7)
 O6 .6822(2) .0711(2) .39622(8) .0469(6)
 C7 .8083(3) .0528(3) .43061(11) .0469(9)
 C8 .7565(4) -.0172(3) .48224(12) .0523(10)
 C9 .8905(5) -.0486(4) .51564(14) .0731(14)
 C10 .9956(5) -.1336(4) .4836(2) .0747(14)
 C11 1.0440(4) -.0667(4) .4329(2) .0630(12)
 C12 .9144(3) -.0266(3) .39911(13) .0494(10)
 C13 1.1472(6) -.1489(6) .4001(3) .093(2)
 C14 .6426(5) .0555(4) .5169(2) .0775(15)
 C15 .4916(5) .0338(5) .4988(2) .101(2)
 C16 .6778(7) .2022(4) .5250(2) .094(2)
 C17 .2785(3) .2719(3) .33767(10) .0386(8)
 O18 .2318(2) .1621(2) .34827(8) .0534(7)
 N19 .1944(2) .3734(3) .32296(10) .0472(8)
 C20 .2417(3) .5049(3) .30703(13) .0479(9)
 C21 .1864(4) .5376(4) .25168(15) .0584(11)
 O22 .0349(2) .5255(3) .24950(10) .0684(9)
 C23 -.0059(4) .3937(4) .2616(2) .0666(13)
 C24 .0395(3) .3533(4) .3177(2) .0623(12)
 C25 .4683(3) .2372(2) .23564(9) .0354(7)
 C26 .3630(3) .1409(3) .22892(12) .0452(9)
 C27 .3125(4) .1107(3) .17717(12) .0549(10)
 C28 .3646(4) .1743(3) .13310(13) .0576(11)
 C29 .4680(4) .2688(3) .13873(12) .0572(11)
 C30 .5206(3) .3002(3) .18979(11) .0474(9)
 H1 .487(3) .100(3) .3378(11) .043(7)
 H2 .462(2) .378(2) .3603(9) .026(6)
 H3 .609(3) .323(3) .2851(10) .037(7)
 H7 .847(3) .140(3) .4393(11) .044(7)
 H8 .712(3) -.103(3) .4705(10) .038(7)
 H9A .927(3) .048(3) .5307(12) .052(9)
 H9B .857(5) -.108(4) .548(2) .106(14)
 H10A .939(6) -.224(5) .471(2) .13(2)
 H10B 1.083(4) -.158(4) .510(2) .083(11)
 H11 1.091(4) -.004(4) .437(2) .067(12)
 H12A .863(4) -.121(4) .3867(14) .073(10)
 H12B .937(3) .029(3) .3731(14) .062(10)
 H13A 1.104(4) -.226(4) .3969(15) .063(12)
 H13B 1.237(5) -.178(4) .418(2) .098(14)
 H13C 1.173(5) -.105(4) .364(2) .097(14)
 H14 .6489 .0147 .5519 .078(11)
 H15A .4748 -.0592 .4944 .096(15)
 H15B .4763 .0781 .4649 .20(3)
 H15C .4270 .0685 .5254 .28(5)
 H16A .780(6) .257(6) .528(2) .14(2)
 H16B .659(5) .251(4) .486(2) .090(12)
 H16C .603(4) .237(4) .558(2) .090(12)
 H20A .203(4) .576(4) .3335(14) .075(10)
 H20B .344(4) .493(4) .3123(14) .076(11)
 H21A .233(4) .472(4) .2215(13) .076(11)
 H21B .203(4) .621(4) .245(2) .076(12)
 H23A .040(4) .325(3) .2344(14) .066(10)
 H23B -.113(4) .386(4) .259(2) .090(12)
 H24A .023(4) .249(4) .3227(14) .074(11)
 H24B -.008(4) .406(4) .3413(14) .072(11)
 H26 .336(3) .095(3) .2588(11) .032(7)
 H27 .236(4) .037(4) .1736(14) .080(11)
 H28 .334(4) .130(4) .106(2) .088(13)
 H29 .508(4) .314(3) .1132(15) .065(10)
 H30 .598(4) .372(3) .1935(13) .065(9)