data_2005139
_journal_name_full  'Acta Crystallographica'
_journal_year      1996
_journal_volume    	C52
_journal_page_first    	1713
_journal_page_last    	1716
_publ_section_title    	
;
Morusin and Morusin Dimethyl Ether
;
_chemical_formula_sum    	'C27 H28 O6'
_chemical_formula_weight    	448.49
_symmetry_cell_setting    	'triclinic'
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
_symmetry_space_group_name_H-M    	'P -1'
_cell_length_a    	11.326(2)
_cell_length_b    	11.806(2)
_cell_length_c    	9.688(2)
_cell_angle_alpha    	99.87(2)
_cell_angle_beta    	103.31(2)
_cell_angle_gamma    	105.73(1)
_cell_volume    	1175.0(4)
_cell_formula_units_Z    	2
_exptl_crystal_density_diffrn    	1.268
_cell_measurement_temperature    	293(2)
loop_
_atom_site_label
_atom_site_occupancy
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
O1 1 0.86515(10) 0.73563(10) 0.60875(12) 0.0454(3)
C2 1 0.9886(2) 0.74042(14) 0.6719(2) 0.0448(4)
C3 1 1.0585(2) 0.69261(15) 0.5988(2) 0.0470(4)
C4 1 1.0044(2) 0.63754(15) 0.4426(2) 0.0479(4)
O4 1 1.06682(13) 0.59520(13) 0.3679(2) 0.0649(4)
C5 1 0.8107(2) 0.58130(15) 0.2257(2) 0.0466(4)
O5 1 0.87243(13) 0.53502(13) 0.13813(14) 0.0600(4)
H5 1 0.9426(11) 0.5373(22) 0.1880(4) 0.084(8)
C6 1 0.6862(2) 0.5762(2) 0.1679(2) 0.0480(4)
H6 1 0.6445(2) 0.5416(2) 0.0687(2) 0.064(6)
C7 1 0.6230(2) 0.62290(15) 0.2584(2) 0.0441(4)
C8 1 0.6818(2) 0.67796(14) 0.4079(2) 0.0429(4)
C9 1 0.8077(2) 0.68113(14) 0.4626(2) 0.0412(4)
C10 1 0.8750(2) 0.63400(14) 0.3770(2) 0.0436(4)
C1' 1 1.0336(2) 0.80509(15) 0.8292(2) 0.0451(4)
C2' 1 1.10261(15) 0.92985(15) 0.8725(2) 0.0445(4)
O2' 1 1.11674(13) 0.98447(11) 0.76139(13) 0.0567(4)
C3' 1 1.1500(2) 0.9898(2) 1.0187(2) 0.0479(4)
H3' 1 1.1964(2) 1.0723(2) 1.0470(2) 0.059(5)
C4' 1 1.1282(2) 0.9268(2) 1.1239(2) 0.0491(4)
O4' 1 1.17954(14) 0.99620(13) 1.26450(14) 0.0647(4)
C5' 1 1.0596(2) 0.8044(2) 1.0839(2) 0.0552(5)
H5' 1 1.0452(2) 0.7624(2) 1.1545(2) 0.071(6)
C6' 1 1.0125(2) 0.7451(2) 0.9360(2) 0.0535(5)
H6' 1 0.9656(2) 0.6628(2) 0.9082(2) 0.060(5)
C7' 1 1.2027(2) 1.1046(2) 0.7989(3) 0.0737(6)
H7'A 1 1.2032(12) 1.1327(6) 0.7117(3) 0.100(5)
H7'B 1 1.2874(4) 1.1059(3) 0.8470(16) 0.100(5)
H7'C 1 1.1757(9) 1.1567(3) 0.8636(15) 0.100(5)
C8' 1 1.1596(3) 0.9401(3) 1.3790(2) 0.0875(8)
H8'A 1 1.2027(16) 0.9983(5) 1.4717(2) 0.116(6)
H8'B 1 1.1930(17) 0.8735(11) 1.3746(13) 0.116(6)
H8'C 1 1.0694(3) 0.9105(16) 1.3683(12) 0.116(6)
O7 1 0.50207(11) 0.62058(12) 0.19378(12) 0.0543(3)
C11 1 1.1924(2) 0.6973(2) 0.6742(2) 0.0560(5)
H11A 1 1.1951(2) 0.6830(2) 0.7704(2) 0.076(7)
H11B 1 1.2122(2) 0.6320(2) 0.6186(2) 0.077(7)
C12 1 1.2939(2) 0.8154(2) 0.6916(2) 0.0552(5)
H12 1 1.2682(2) 0.8714(2) 0.6457(2) 0.072(6)
C13 1 1.4149(2) 0.8469(2) 0.7652(2) 0.0604(5)
C14 1 1.5087(2) 0.9670(2) 0.7747(4) 0.0938(9)
H14A 1 1.5491(13) 1.0100(7) 0.8757(4) 0.112(6)
H14B 1 1.4645(4) 1.0139(7) 0.7249(17) 0.112(6)
H14C 1 1.5727(10) 0.9541(2) 0.7297(18) 0.112(6)
C15 1 1.4704(2) 0.7647(3) 0.8408(4) 0.1028(10)
H15A 1 1.5519(13) 0.7694(20) 0.8247(27) 0.175(10)
H15B 1 1.4132(14) 0.6826(5) 0.8023(23) 0.175(10)
H15C 1 1.4815(26) 0.7892(17) 0.9440(6) 0.175(10)
C16 1 0.4149(2) 0.6295(2) 0.2837(2) 0.0511(4)
C17 1 0.4882(2) 0.7143(2) 0.4319(2) 0.0592(5)
H17 1 0.4453(2) 0.7541(2) 0.4837(2) 0.083(7)
C18 1 0.6120(2) 0.7340(2) 0.4911(2) 0.0528(5)
H18 1 0.6539(2) 0.7834(2) 0.5852(2) 0.067(6)
C19 1 0.3520(2) 0.5038(2) 0.2980(3) 0.0753(6)
H19A 1 0.2944(11) 0.5074(3) 0.3562(14) 0.094(5)
H19B 1 0.4165(3) 0.4727(6) 0.3444(16) 0.094(5)
H19C 1 0.3050(13) 0.4513(4) 0.2025(3) 0.094(5)
C20 1 0.3187(2) 0.6779(2) 0.1986(2) 0.0676(6)
H20A 1 0.2557(8) 0.6827(13) 0.2489(9) 0.088(4)
H20B 1 0.2772(10) 0.6243(7) 0.1026(6) 0.088(4)
H20C 1 0.3619(3) 0.7573(6) 0.1903(14) 0.088(4)