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. 2018 Jul 6;74(Pt 8):1058–1062. doi: 10.1107/S2056989018009593
x y z Uiso*/Ueq
O1 0.3838 (4) 0.5521 (4) 0.45124 (15) 0.0153 (5)
H1 0.271 (6) 0.587 (8) 0.468 (3) 0.039 (13)*
O2 0.3808 (3) 0.8867 (4) 0.35486 (14) 0.0156 (5)
O3 0.9421 (3) 0.1722 (4) 0.44956 (14) 0.0133 (5)
O4 1.0688 (3) 0.2205 (4) 0.30548 (14) 0.0141 (5)
H4 1.173 (6) 0.144 (7) 0.332 (2) 0.026 (10)*
O5 0.7890 (3) 0.7805 (3) 0.30380 (14) 0.0123 (5)
O6 0.6993 (3) 0.4106 (4) 0.23156 (13) 0.0127 (4)
C1 0.4679 (4) 0.7060 (5) 0.38994 (19) 0.0108 (6)
C2 0.6954 (4) 0.6301 (5) 0.3722 (2) 0.0113 (6)
H2 0.782988 0.639980 0.433289 0.014*
C3 0.7155 (4) 0.3667 (5) 0.33022 (19) 0.0103 (6)
H3 0.591522 0.263933 0.348493 0.012*
C4 0.9202 (4) 0.2424 (5) 0.3672 (2) 0.0105 (6)
C5 0.7661 (4) 0.6609 (5) 0.2121 (2) 0.0124 (6)
C6 0.6025 (5) 0.7952 (6) 0.1454 (2) 0.0174 (7)
H6A 0.481549 0.683619 0.127887 0.021*
H6B 0.547171 0.945453 0.176471 0.021*
C7 0.7213 (5) 0.8670 (7) 0.0571 (2) 0.0276 (8)
H7A 0.704227 0.737514 0.007304 0.033*
H7B 0.669165 1.027909 0.030732 0.033*
C8 0.9535 (5) 0.8873 (7) 0.0939 (2) 0.0220 (7)
H8A 1.051505 0.869535 0.041494 0.026*
H8B 0.981059 1.048463 0.126290 0.026*
C9 0.9776 (4) 0.6711 (6) 0.1634 (2) 0.0161 (6)
H9A 1.097196 0.700938 0.210352 0.019*
H9B 1.003536 0.513540 0.129416 0.019*