data_2000305
_journal_name_full 'Acta Cryst. C'
_journal_year   1991
_journal_volume  47
_journal_page_first  1261
_journal_page_last  1263
_chemical_formula_sum  'C42 H50 N2 O2'
_symmetry_cell_setting  orthorhombic
_symmetry_space_group_name_h-m  P212121
_symmetry_space_group_name_hall  ?
_cell_length_a  10.071(7)
_cell_length_b  19.218(15)
_cell_length_c  19.406(14)
_cell_angle_alpha  90
_cell_angle_beta  90
_cell_angle_gamma  90
_cell_volume  3756
_cell_formula_units_z  8
_exptl_crystal_density_diffrn  1.09
_exptl_crystal_density_meas  ?
_exptl_crystal_F_000  ?
_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
 O(1) .9864(5) .6205(3) .1634(3) .068(2)
 O(2) .4856(6) .6314(3) .1287(3) .071(2)
 N(1) .7765(6) .6422(3) .1335(4) .051(3)
 N(2) .2732(7) .6465(4) .1579(4) .061(3)
 C(11) .8255(8) .7679(4) .1263(5) .052(3)
 C(12) .9055(8) .8202(5) .1031(5) .062(4)
 C(13) .9107(10) .8821(6) .1353(6) .080(5)
 C(14) .8434(12) .8955(6) .1941(6) .094(5)
 C(15) .7617(11) .8428(6) .2189(5) .093(5)
 C(16) .7562(9) .7791(5) .1861(5) .070(4)
 C(17) .8093(8) .7000(4) .0884(4) .056(3)
 C(18) .7098(9) .7071(4) .0308(4) .081(4)
 C(19) .8673(9) .6079(4) .1691(4) .049(3)
 C(110) .8236(8) .5488(4) .2184(5) .051(3)
 C(111) .6765(7) .5509(4) .2355(5) .074(4)
 C(112) .9064(9) .5545(5) .2839(4) .074(4)
 C(113) .8859(11) .6186(5) .3244(5) .107(5)
 C(114) .8647(10) .4828(6) .1831(5) .080(4)
 C(115) .8017(12) .4327(6) .1589(6) .093(5)
 C(116) .8485(13) .3691(5) .1239(6) .076(4)
 C(117) .7603(12) .3286(8) .0865(7) .116(6)
 C(118) .802(2)   .2700(9) .0542(8) .142(9)
 C(119) .928(2)   .2501(8) .0563(8) .121(7)
 C(120) 1.0183(13) .2890(8) .0932(7) .108(6)
 C(121) .9735(15) .3474(7) .1243(6) .098(6)
 C(21) .3668(9) .6802(6) .2705(5) .064(4)
 C(22) .3306(11) .6212(6) .3021(7) .098(5)
 C(23) .3860(15) .6009(8) .3633(8) .123(7)
 C(24) .4795(19) .6401(9) .3935(8) .144(9)
 C(25) .5138(13) .7012(9) .3653(7) .126(7)
 C(26) .4590(10) .7207(5) .3024(5) .082(4)
 C(27) .3033(8) .7041(5) .2029(5) .061(4)
 C(28) .1789(8) .7474(4) .2152(5) .086(4)
 C(29) .3702(10) .6123(5) .1260(5) .057(4)
 C(210) .3292(7) .5469(5) .0866(4) .057(3)
 C(211) .2829(9) .4925(4) .1399(4) .075(4)
 C(212) .4528(8) .5192(5) .0472(5) .075(4)
 C(213) .4296(10) .4546(5) .0060(5) .115(5)
 C(214) .2227(8) .5647(4) .0347(5) .060(3)
 C(215) .1040(8) .5373(4) .0288(4) .062(4)
 C(216) .0042(8) .5559(4) -.0229(5) .055(3)
 C(217) -.1218(10) .5253(5) -.0197(5) .070(4)
 C(218) -.2146(10) .5400(6) -.0674(6) .080(4)
 C(219) -.1917(11) .5857(5) -.1192(6) .083(5)
 C(220) -.0681(11) .6154(5) -.1245(5) .086(4)
 C(221) .0262(9) .6020(5) -.0766(5) .075(4)
 H(1a) .6909 .6289 .1358 .080
 H(2a) .1874 .6343 .1533 .080
 H(12a) .9594 .8112 .0633 .080
 H(13a) .9655 .9189 .1178 .080
 H(14a) .8437 .9400 .2164 .080
 H(15a) .7135 .8503 .2610 .080
 H(16a) .7021 .7426 .2050 .080
 H(17a) .8931 .6901 .0669 .080
 H(18a) .7049 .6647 .0047 .080
 H(18b) .7312 .7450 .0005 .080
 H(18c) .6258 .7159 .0525 .080
 H(11a) .6529 .5137 .2661 .080
 H(11b) .6256 .5471 .1938 .080
 H(11c) .6581 .5947 .2572 .080
 H(11d) .8916 .5143 .3123 .080
 H(11e) .9981 .5546 .2704 .080
 H(11f) .9424 .6198 .3642 .080
 H(11g) .7947 .6182 .3388 .080
 H(11h) .9022 .6589 .2965 .080
 H(11i) .9584 .4780 .1752 .080
 H(11j) .7078 .4371 .1662 .080
 H(11k) .6697 .3433 .0820 .070
 H(11m) .7430 .2424 .0266 .080
 H(11n) .9544 .2080 .0335 .080
 H(12b) 1.1094 .2724 .0967 .070
 H(12d) 1.0357 .3750 .1499 .080
 H(22a) .2696 .5900 .2799 .080
 H(23a) .3570 .5604 .3881 .080
 H(24a) .5248 .6243 .4341 .080
 H(25a) .5767 .7297 .3893 .080
 H(26a) .4866 .7635 .2812 .080
 H(27a) .3663 .7331 .1795 .080
 H(28a) .1420 .7633 .1724 .080
 H(28b) .1976 .7867 .2442 .080
 H(26c) .1165 .7173 .2378 .080
 H(21a) .2055 .5093 .1636 .080
 H(21b) .3540 .4865 .1723 .080
 H(21c) .2630 .4487 .1184 .080
 H(21d) .4829 .5557 .0173 .080
 H(21e) .5224 .5097 .0797 .080
 H(21f) .5096 .4412 -.0173 .080
 H(21g) .3614 .4640 -.0272 .080
 H(21h) .4014 .4175 .0357 .080
 H(21i) .2450 .5992 .0008 .080
 H(21j) .0796 .5026 .0620 .080
 H(21k) -.1399 .4920 .0160 .080
 H(211) -.2993 .5171 -.0655 .080
 H(21m) -.2623 .5974 -.1503 .080
 H(22b) -.0492 .6467 -.1617 .080
 H(22c) .1122 .6233 -.0800 .080