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. 2010 Oct 23;66(Pt 11):o2915. doi: 10.1107/S1600536810041383
x y z Uiso*/Ueq
O1 0.78175 (8) 0.89233 (13) 0.62825 (14) 0.0252 (3)
H1 0.7466 (13) 0.885 (3) 0.567 (2) 0.086 (12)*
O2 0.42198 (8) 0.93692 (14) 0.03223 (14) 0.0291 (4)
O3 0.43875 (7) 0.73467 (13) −0.01081 (13) 0.0237 (3)
N1 0.67954 (9) 0.79668 (16) 0.46645 (16) 0.0222 (4)
C1 0.78970 (11) 0.77878 (18) 0.68363 (19) 0.0203 (4)
C2 0.84179 (10) 0.76051 (18) 0.78972 (18) 0.0186 (4)
C3 0.85050 (10) 0.63866 (18) 0.83515 (18) 0.0180 (4)
H3 0.8862 0.6243 0.9054 0.022*
C4 0.80999 (10) 0.53616 (18) 0.78384 (18) 0.0183 (4)
C5 0.75592 (10) 0.56031 (19) 0.68469 (18) 0.0199 (4)
H5 0.7253 0.4941 0.6509 0.024*
C6 0.74560 (10) 0.67938 (19) 0.63368 (18) 0.0201 (4)
C7 0.94204 (12) 0.9088 (2) 0.7566 (2) 0.0290 (5)
H7A 0.9137 0.9359 0.6780 0.044*
H7B 0.9735 0.8388 0.7402 0.044*
H7C 0.9722 0.9782 0.7930 0.044*
C8 0.88965 (11) 0.86740 (19) 0.84883 (19) 0.0219 (4)
C9 0.84263 (13) 0.9784 (2) 0.8811 (2) 0.0295 (5)
H9A 0.8124 1.0072 0.8051 0.044*
H9B 0.8744 1.0464 0.9158 0.044*
H9C 0.8112 0.9521 0.9428 0.044*
C10 0.93590 (13) 0.8274 (2) 0.9709 (2) 0.0304 (5)
H10A 0.9670 0.7569 0.9542 0.046*
H10B 0.9037 0.8024 1.0320 0.046*
H10C 0.9665 0.8974 1.0044 0.046*
C11 0.82432 (11) 0.40232 (18) 0.82969 (18) 0.0197 (4)
C12 0.75683 (11) 0.3511 (2) 0.8825 (2) 0.0254 (5)
H12A 0.7465 0.4030 0.9529 0.038*
H12B 0.7662 0.2652 0.9111 0.038*
H12C 0.7148 0.3526 0.8169 0.038*
C13 0.84080 (12) 0.3212 (2) 0.7192 (2) 0.0259 (5)
H13A 0.8838 0.3540 0.6858 0.039*
H13B 0.7988 0.3225 0.6535 0.039*
H13C 0.8502 0.2352 0.7479 0.039*
C14 0.88904 (11) 0.3930 (2) 0.9334 (2) 0.0247 (5)
H14A 0.9330 0.4251 0.9025 0.037*
H14B 0.8966 0.3056 0.9583 0.037*
H14C 0.8789 0.4423 1.0057 0.037*
C15 0.68922 (11) 0.69415 (19) 0.52586 (19) 0.0219 (4)
H15 0.6589 0.6250 0.4995 0.026*
C16 0.62487 (10) 0.8028 (2) 0.36008 (19) 0.0213 (4)
C17 0.59190 (11) 0.9167 (2) 0.3314 (2) 0.0235 (5)
H17 0.6062 0.9876 0.3815 0.028*
C18 0.53831 (11) 0.9279 (2) 0.23032 (19) 0.0228 (5)
H18 0.5157 1.0064 0.2116 0.027*
C19 0.51707 (10) 0.82475 (19) 0.15535 (19) 0.0202 (4)
C20 0.55214 (11) 0.7112 (2) 0.18075 (19) 0.0214 (4)
H20 0.5391 0.6411 0.1286 0.026*
C21 0.60615 (11) 0.7002 (2) 0.28224 (19) 0.0234 (5)
H21 0.6305 0.6228 0.2990 0.028*
C22 0.45526 (11) 0.84073 (19) 0.05346 (19) 0.0209 (4)
C23 0.37799 (11) 0.7442 (2) −0.1100 (2) 0.0265 (5)
H23A 0.3908 0.8002 −0.1768 0.032*
H23B 0.3347 0.7788 −0.0767 0.032*
C24 0.36159 (12) 0.6163 (2) −0.1613 (2) 0.0281 (5)
H24A 0.3206 0.6204 −0.2286 0.042*
H24B 0.3488 0.5616 −0.0945 0.042*
H24C 0.4046 0.5830 −0.1944 0.042*