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. 2011 Oct 8;67(Pt 11):o2863. doi: 10.1107/S1600536811040566
x y z Uiso*/Ueq
O1 0.80658 (9) 0.22692 (10) 0.28201 (4) 0.0261 (2)
O2 0.89760 (9) 0.55049 (10) 0.10826 (4) 0.0273 (2)
O3 0.67881 (9) 0.58836 (11) 0.11454 (5) 0.0314 (2)
O4 0.81461 (10) 0.44760 (11) −0.00431 (5) 0.0356 (3)
O5 1.01727 (10) 0.81990 (11) 0.09170 (5) 0.0349 (3)
C6 0.68207 (13) 0.36659 (14) 0.21024 (6) 0.0237 (3)
H6A 0.6008 0.3944 0.1960 0.028*
C7 0.78634 (13) 0.42777 (14) 0.18443 (6) 0.0244 (3)
H7A 0.8686 0.4048 0.1989 0.029*
N8 0.89355 (11) 0.63213 (12) 0.05495 (5) 0.0246 (3)
C9 0.68679 (12) 0.26114 (14) 0.25831 (6) 0.0220 (3)
C10 0.77299 (13) 0.52965 (14) 0.13407 (6) 0.0233 (3)
C11 0.96337 (13) 0.76125 (14) 0.04991 (6) 0.0243 (3)
C12 0.59420 (14) 0.18035 (14) 0.28687 (6) 0.0255 (3)
H12A 0.5054 0.1829 0.2793 0.031*
C13 0.85503 (13) 0.56972 (15) 0.00020 (6) 0.0250 (3)
C14 0.65847 (14) 0.09163 (15) 0.33025 (6) 0.0270 (3)
H14A 0.6205 0.0249 0.3566 0.032*
C15 0.78534 (14) 0.12362 (15) 0.32556 (6) 0.0279 (3)
H15A 0.8503 0.0810 0.3489 0.034*
C16 0.87575 (15) 0.68378 (15) −0.04765 (6) 0.0289 (3)
H16A 0.7934 0.7229 −0.0614 0.035*
H16B 0.9214 0.6439 −0.0826 0.035*
C17 0.95729 (14) 0.80146 (15) −0.01663 (6) 0.0286 (3)
H17A 1.0438 0.8046 −0.0341 0.034*
H17B 0.9170 0.8956 −0.0217 0.034*