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. 2022 Jun 7;78(Pt 7):687–690. doi: 10.1107/S205698902200576X
x y z Uiso*/Ueq
Cl1 0.30989 (3) 0.41222 (3) 0.90827 (3) 0.03169 (9)
O1 0.43630 (10) 0.27410 (8) 0.71560 (10) 0.03148 (19)
O2 0.99240 (9) 0.34016 (9) 0.56309 (9) 0.03316 (19)
N1 0.53618 (9) 0.48405 (8) 0.70583 (9) 0.02160 (17)
H1 0.5353 (17) 0.5749 (9) 0.7222 (16) 0.034 (4)*
C1 0.32272 (11) 0.47958 (10) 0.75260 (11) 0.02423 (19)
H1A 0.226444 0.470886 0.667909 0.029*
H1B 0.348725 0.579198 0.767150 0.029*
C2 0.43834 (11) 0.40146 (10) 0.72459 (10) 0.02147 (19)
C3 0.64850 (11) 0.44121 (10) 0.66649 (10) 0.02036 (18)
C4 0.63724 (11) 0.32251 (10) 0.58566 (11) 0.02264 (19)
H4 0.552126 0.265906 0.555512 0.027*
C5 0.75029 (11) 0.28609 (10) 0.54860 (10) 0.02332 (19)
H5 0.742024 0.204773 0.493437 0.028*
C6 0.87484 (11) 0.36845 (11) 0.59218 (11) 0.02389 (19)
C7 0.88452 (12) 0.48995 (11) 0.66987 (12) 0.0275 (2)
H7 0.968462 0.547843 0.697712 0.033*
C8 0.77218 (12) 0.52620 (10) 0.70637 (11) 0.0249 (2)
H8 0.779097 0.609174 0.758744 0.030*
C9 0.97987 (13) 0.22369 (13) 0.47330 (13) 0.0325 (2)
H9A 1.070019 0.214361 0.460154 0.049*
H9B 0.896160 0.237045 0.379304 0.049*
H9C 0.964803 0.139514 0.518658 0.049*