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. 2024 Jun 21;80(Pt 7):767–770. doi: 10.1107/S205698902400584X
x y z Uiso*/Ueq
O1 0.8531 (2) 0.18982 (18) 0.34863 (13) 0.0878 (6)
O2 0.89842 (16) 0.42028 (16) 0.33853 (10) 0.0657 (4)
O3 0.73548 (14) 0.51487 (15) 0.57413 (9) 0.0611 (4)
O4 0.5562 (2) 0.3555 (2) 0.56376 (12) 0.0961 (7)
C1 0.78028 (18) 0.4741 (2) 0.49394 (12) 0.0521 (4)
C2 0.7829 (2) 0.3396 (2) 0.46205 (14) 0.0601 (5)
H2 0.7447 0.2654 0.4923 0.072*
C3 0.8442 (2) 0.3080 (2) 0.38166 (15) 0.0637 (5)
C4 0.89359 (19) 0.5596 (2) 0.36974 (13) 0.0552 (5)
C5 0.9492 (2) 0.6653 (3) 0.32029 (15) 0.0686 (6)
H5 0.9891 0.6417 0.2689 0.082*
C6 0.9443 (3) 0.8055 (3) 0.34855 (18) 0.0770 (7)
H6 0.9807 0.8776 0.3155 0.092*
C7 0.8862 (3) 0.8417 (2) 0.42546 (19) 0.0769 (6)
H7 0.8837 0.9373 0.4439 0.092*
C8 0.8321 (2) 0.7356 (2) 0.47459 (15) 0.0640 (5)
H8 0.7930 0.7600 0.5263 0.077*
C9 0.83527 (18) 0.5928 (2) 0.44771 (13) 0.0514 (4)
C10 0.6263 (2) 0.4471 (2) 0.60627 (13) 0.0588 (5)
C11 0.6104 (3) 0.5117 (3) 0.69639 (16) 0.0763 (7)
H11A 0.5905 0.6134 0.6862 0.092*
H11B 0.7010 0.5039 0.7392 0.092*
C12 0.4994 (3) 0.4499 (3) 0.74266 (16) 0.0776 (7)
H12A 0.4091 0.4569 0.6995 0.093*
H12B 0.5199 0.3484 0.7531 0.093*
C13 0.4818 (4) 0.5132 (4) 0.8311 (2) 0.1043 (11)
H13A 0.4636 0.6150 0.8203 0.125*
H13B 0.5723 0.5050 0.8739 0.125*
C14 0.3720 (4) 0.4574 (4) 0.8790 (2) 0.1154 (12)
H14A 0.2833 0.4508 0.8355 0.173*
H14B 0.3614 0.5211 0.9291 0.173*
H14C 0.3992 0.3637 0.9038 0.173*