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) |