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. 2020 May 22;76(Pt 6):896–899. doi: 10.1107/S2056989020006441
x y z Uiso*/Ueq
O1 0.44518 (18) 0.62766 (11) 0.68257 (5) 0.0247 (3)
O2 0.61050 (17) 0.49358 (11) 0.75201 (5) 0.0259 (3)
C1 −0.0406 (2) 0.65397 (15) 0.55785 (7) 0.0198 (4)
C2 −0.0799 (2) 0.59770 (15) 0.51299 (7) 0.0211 (4)
H2 −0.1346 0.6322 0.4834 0.025*
C3 −0.0254 (2) 0.47506 (15) 0.51698 (7) 0.0197 (4)
C4 0.0428 (3) 0.45757 (16) 0.56522 (6) 0.0207 (4)
H4 0.0855 0.3857 0.5784 0.025*
C5 0.0400 (2) 0.56652 (15) 0.59360 (6) 0.0196 (4)
C6 0.1117 (2) 0.58571 (15) 0.64113 (7) 0.0204 (4)
H6 0.1098 0.6635 0.6531 0.024*
C7 −0.0696 (2) 0.77839 (15) 0.56788 (7) 0.0201 (4)
C8 −0.1120 (3) 0.82200 (15) 0.61722 (7) 0.0232 (4)
H8 −0.1192 0.7705 0.6459 0.028*
C9 −0.1436 (3) 0.93976 (16) 0.62481 (8) 0.0276 (4)
H9 −0.1710 0.9678 0.6586 0.033*
C10 −0.1352 (3) 1.01607 (17) 0.58346 (8) 0.0302 (4)
H10 −0.1570 1.0963 0.5887 0.036*
C11 −0.0945 (3) 0.97418 (17) 0.53435 (8) 0.0302 (4)
H11 −0.0895 1.0260 0.5058 0.036*
C12 −0.0612 (3) 0.85764 (16) 0.52664 (7) 0.0252 (4)
H12 −0.0321 0.8307 0.4928 0.030*
C13 −0.0383 (2) 0.38948 (15) 0.47494 (6) 0.0198 (4)
C14 −0.1483 (3) 0.40870 (16) 0.43146 (7) 0.0240 (4)
H14 −0.2167 0.4783 0.4289 0.029*
C15 −0.1585 (3) 0.32715 (17) 0.39190 (7) 0.0274 (4)
H15 −0.2351 0.3408 0.3628 0.033*
C16 −0.0574 (3) 0.22612 (16) 0.39474 (7) 0.0252 (4)
H16 −0.0638 0.1707 0.3675 0.030*
C17 0.0532 (3) 0.20609 (16) 0.43754 (7) 0.0243 (4)
H17 0.1233 0.1371 0.4395 0.029*
C18 0.0617 (3) 0.28622 (16) 0.47734 (7) 0.0229 (4)
H18 0.1363 0.2711 0.5067 0.028*
C19 0.1926 (2) 0.49925 (15) 0.67648 (7) 0.0194 (4)
C20 0.3601 (2) 0.52592 (15) 0.69714 (7) 0.0206 (4)
C21 0.4485 (3) 0.45362 (15) 0.73404 (6) 0.0211 (4)
C22 0.3672 (3) 0.35129 (15) 0.74809 (7) 0.0216 (4)
H22 0.4269 0.3012 0.7719 0.026*
C23 0.1953 (3) 0.31938 (15) 0.72749 (6) 0.0198 (4)
C24 0.1143 (3) 0.21256 (16) 0.74162 (7) 0.0233 (4)
H24 0.1763 0.1620 0.7647 0.028*
C25 −0.0526 (3) 0.18134 (16) 0.72228 (7) 0.0254 (4)
H25 −0.1043 0.1087 0.7314 0.030*
C26 −0.1476 (3) 0.25666 (16) 0.68892 (7) 0.0250 (4)
H26 −0.2644 0.2353 0.6762 0.030*
C27 −0.0726 (2) 0.36052 (16) 0.67463 (6) 0.0222 (4)
H27 −0.1393 0.4111 0.6526 0.027*
C28 0.1027 (2) 0.39369 (15) 0.69210 (6) 0.0187 (4)
C29 0.5376 (3) 0.61847 (19) 0.63345 (8) 0.0317 (4)
H29A 0.4567 0.5819 0.6080 0.048*
H29B 0.6476 0.5714 0.6376 0.048*
H29C 0.5714 0.6960 0.6213 0.048*
C30 0.6930 (3) 0.42942 (18) 0.79361 (8) 0.0297 (4)
H30A 0.7212 0.3508 0.7817 0.044*
H30B 0.6085 0.4256 0.8230 0.044*
H30C 0.8055 0.4681 0.8045 0.044*