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. 2021 Sep 28;77(Pt 10):1048–1053. doi: 10.1107/S2056989021009907
x y z Uiso*/Ueq
C1 0.57432 (13) 0.4170 (2) 0.17193 (10) 0.0396 (4)
C2 0.53382 (14) 0.2461 (3) 0.14061 (12) 0.0450 (5)
C10 0.57234 (13) 0.6612 (2) 0.24521 (11) 0.0386 (4)
H10A 0.533570 0.757230 0.231289 0.046*
H10B 0.628106 0.679444 0.228600 0.046*
C11 0.59728 (12) 0.6449 (2) 0.32991 (11) 0.0353 (4)
C12 0.64935 (13) 0.7922 (2) 0.37350 (12) 0.0445 (5)
H12A 0.686507 0.866559 0.356181 0.053*
C13 0.63075 (14) 0.7916 (2) 0.44014 (12) 0.0473 (5)
H13A 0.651717 0.865687 0.479366 0.057*
C14 0.56784 (13) 0.6447 (2) 0.43983 (11) 0.0417 (4)
H14A 0.530748 0.647835 0.477024 0.050*
C14A 0.62536 (12) 0.4899 (2) 0.44023 (11) 0.0390 (4)
C15 0.65706 (14) 0.3678 (3) 0.49181 (12) 0.0466 (5)
H15A 0.643575 0.368000 0.538795 0.056*
C16 0.71008 (15) 0.2436 (3) 0.47154 (13) 0.0531 (5)
H16A 0.731376 0.158196 0.505157 0.064*
C17 0.73137 (15) 0.2450 (3) 0.40299 (13) 0.0521 (5)
H17A 0.767642 0.161342 0.391117 0.062*
C18 0.69959 (13) 0.3700 (2) 0.35035 (12) 0.0436 (4)
H18A 0.714646 0.371239 0.303977 0.052*
C18A 0.64551 (11) 0.4905 (2) 0.36943 (10) 0.0356 (4)
C20 0.42684 (12) 0.5001 (2) 0.20562 (10) 0.0359 (4)
H20A 0.422213 0.498360 0.257597 0.043*
H20B 0.404568 0.395232 0.183106 0.043*
C21 0.36523 (12) 0.6346 (2) 0.16411 (10) 0.0348 (4)
C22 0.37783 (13) 0.7010 (3) 0.08860 (11) 0.0440 (4)
H22A 0.405680 0.647375 0.055171 0.053*
C23 0.34135 (14) 0.8485 (3) 0.08083 (13) 0.0503 (5)
H23A 0.338084 0.920840 0.040843 0.060*
C24 0.30557 (14) 0.8769 (2) 0.15056 (12) 0.0467 (5)
H24A 0.296146 0.991967 0.162742 0.056*
C24A 0.22319 (13) 0.7630 (2) 0.14421 (10) 0.0396 (4)
C25 0.12998 (14) 0.7862 (3) 0.13138 (11) 0.0485 (5)
H25A 0.104624 0.891139 0.125152 0.058*
C26 0.07468 (15) 0.6477 (3) 0.12801 (12) 0.0556 (6)
H26A 0.011307 0.660262 0.118843 0.067*
C27 0.11209 (14) 0.4931 (3) 0.13797 (12) 0.0558 (6)
H27A 0.073843 0.402457 0.136186 0.067*
C28 0.20793 (13) 0.4696 (3) 0.15092 (11) 0.0448 (4)
H28A 0.233674 0.365028 0.157926 0.054*
C28A 0.26130 (12) 0.6058 (2) 0.15276 (9) 0.0350 (4)
N1 0.52425 (10) 0.51733 (18) 0.20508 (8) 0.0353 (3)
O1 0.65181 (10) 0.4475 (2) 0.16809 (9) 0.0594 (4)
O19 0.51694 (8) 0.64419 (16) 0.36140 (7) 0.0389 (3)
O29 0.37315 (9) 0.78716 (15) 0.20640 (7) 0.0431 (3)
Cl1 0.49921 (4) 0.13248 (6) 0.21124 (4) 0.05856 (17)
Cl2 0.61916 (5) 0.13144 (9) 0.11317 (5) 0.0795 (2)
Cl3 0.44055 (5) 0.27068 (8) 0.06047 (4) 0.0719 (2)