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. 2014 Feb 22;70(Pt 3):o346–o347. doi: 10.1107/S1600536814003845
x y z Uiso*/Ueq
O1 1.23676 (10) 1.1637 (3) 0.78082 (11) 0.0647 (4)
H1A 1.262 (2) 1.285 (6) 0.7532 (18) 0.115 (11)*
C1 1.00323 (13) 0.7254 (3) 0.89293 (11) 0.0435 (4)
H1 0.9915 0.6531 0.9465 0.052*
C2 1.06557 (13) 0.9145 (3) 0.89012 (11) 0.0449 (4)
H2 1.0966 0.9690 0.9433 0.054*
C3 1.08440 (12) 1.0289 (3) 0.81060 (11) 0.0416 (4)
C4 1.03968 (12) 0.9504 (3) 0.72954 (11) 0.0379 (4)
C4A 0.97556 (12) 0.7560 (3) 0.73093 (10) 0.0361 (4)
C5 0.90173 (14) 0.6439 (4) 0.56991 (11) 0.0503 (5)
H5 0.9309 0.7656 0.5396 0.060*
C5A 0.91717 (12) 0.6257 (3) 0.66236 (10) 0.0377 (4)
C6 0.84282 (16) 0.4795 (4) 0.52398 (13) 0.0604 (6)
H6 0.8332 0.4883 0.4622 0.072*
C7 0.79780 (15) 0.3012 (4) 0.56927 (13) 0.0612 (6)
H7 0.7582 0.1924 0.5370 0.073*
C8 0.80997 (14) 0.2801 (3) 0.66092 (13) 0.0510 (5)
H8 0.7793 0.1603 0.6908 0.061*
C8A 0.86991 (12) 0.4451 (3) 0.70644 (11) 0.0381 (4)
N9 0.89428 (10) 0.4597 (3) 0.79697 (9) 0.0404 (4)
C9A 0.95842 (12) 0.6465 (3) 0.81262 (10) 0.0368 (4)
C10 0.86281 (14) 0.2951 (3) 0.86346 (12) 0.0506 (5)
H10B 0.9017 0.1524 0.8682 0.076*
H10A 0.7999 0.2470 0.8462 0.076*
H10C 0.8660 0.3772 0.9199 0.076*
C11 1.05756 (14) 1.0659 (3) 0.64152 (11) 0.0507 (5)
H11B 1.0828 0.9451 0.6043 0.076*
H11C 1.1009 1.1984 0.6519 0.076*
H11A 1.0003 1.1273 0.6125 0.076*
C12 1.15214 (14) 1.2370 (3) 0.81458 (13) 0.0532 (5)
H12A 1.1254 1.3734 0.7798 0.064*
H12B 1.1648 1.2913 0.8757 0.064*