| x | y | z | Uiso*/Ueq | ||
| O1 | 0.39573 (14) | 0.24072 (14) | 0.47478 (7) | 0.0460 (3) | |
| O2 | 0.51722 (14) | 0.20489 (14) | 0.35623 (7) | 0.0463 (3) | |
| O3 | 0.27667 (13) | 0.34038 (12) | 0.34119 (7) | 0.0408 (3) | |
| O4 | 0.25466 (14) | 0.10405 (11) | 0.35921 (8) | 0.0441 (3) | |
| C1 | 0.3646 (2) | 0.22289 (18) | 0.38424 (11) | 0.0384 (4) | |
| C2 | 0.67414 (19) | 0.32183 (17) | 0.56079 (10) | 0.0333 (4) | |
| H2 | 0.6161 | 0.3766 | 0.6022 | 0.0490 (13)* | |
| C3 | 0.56971 (19) | 0.20081 (17) | 0.51341 (10) | 0.0342 (4) | |
| H3 | 0.5742 | 0.1165 | 0.5526 | 0.0490 (13)* | |
| C4 | 0.65286 (19) | 0.17354 (18) | 0.43193 (10) | 0.0368 (4) | |
| H4 | 0.6964 | 0.0755 | 0.4305 | 0.0490 (13)* | |
| C5 | 0.7973 (2) | 0.28116 (18) | 0.44257 (11) | 0.0378 (4) | |
| H5 | 0.8407 | 0.3025 | 0.3869 | 0.0490 (13)* | |
| C6 | 0.9350 (2) | 0.2320 (2) | 0.52188 (12) | 0.0458 (5) | |
| H6A | 1.0433 | 0.2857 | 0.5259 | 0.0490 (13)* | |
| H6B | 0.9600 | 0.1310 | 0.5171 | 0.0490 (13)* | |
| C7 | 0.8509 (2) | 0.26146 (19) | 0.60315 (11) | 0.0439 (4) | |
| H7A | 0.8387 | 0.1743 | 0.6364 | 0.0490 (13)* | |
| H7B | 0.9196 | 0.3298 | 0.6443 | 0.0490 (13)* | |
| C8 | 0.7165 (2) | 0.40464 (17) | 0.48246 (10) | 0.0384 (4) | |
| H8A | 0.6123 | 0.4412 | 0.4420 | 0.0490 (13)* | |
| H8B | 0.7995 | 0.4814 | 0.5018 | 0.0490 (13)* | |
| C9 | 0.12113 (18) | 0.29423 (16) | 0.29208 (9) | 0.0307 (4) | |
| C10 | 0.10837 (18) | 0.15188 (16) | 0.30274 (9) | 0.0307 (4) | |
| C11 | −0.03269 (19) | 0.07732 (17) | 0.26098 (10) | 0.0365 (4) | |
| H11 | −0.0406 | −0.0211 | 0.2681 | 0.0490 (13)* | |
| C12 | −0.16353 (19) | 0.15365 (18) | 0.20764 (10) | 0.0367 (4) | |
| H12 | −0.2643 | 0.1064 | 0.1778 | 0.0490 (13)* | |
| C13 | −0.1506 (2) | 0.29664 (18) | 0.19700 (10) | 0.0375 (4) | |
| H13 | −0.2426 | 0.3454 | 0.1600 | 0.0490 (13)* | |
| C14 | −0.0054 (2) | 0.37112 (17) | 0.23937 (10) | 0.0350 (4) | |
| H14 | 0.0049 | 0.4693 | 0.2320 | 0.0490 (13)* |