| x | y | z | Uiso*/Ueq | ||
| Sn1 | 0.28429 (1) | −0.16993 (2) | 0.22816 (1) | 0.0380 (1) | |
| O1 | 0.32929 (16) | −0.03474 (18) | 0.16907 (8) | 0.0498 (6) | |
| O2 | 0.26730 (17) | 0.1483 (2) | 0.20361 (9) | 0.0529 (7) | |
| C1 | 0.3143 (2) | 0.0940 (3) | 0.17022 (10) | 0.0389 (7) | |
| C2 | 0.3576 (2) | 0.1747 (2) | 0.12708 (11) | 0.0401 (8) | |
| C3 | 0.3324 (3) | 0.3224 (3) | 0.12430 (15) | 0.0591 (10) | |
| C4 | 0.4185 (2) | 0.1119 (3) | 0.09665 (11) | 0.0426 (8) | |
| C5 | 0.4713 (2) | 0.1667 (3) | 0.05244 (12) | 0.0482 (9) | |
| C6 | 0.5691 (3) | 0.1139 (4) | 0.04886 (14) | 0.0663 (11) | |
| C7 | 0.6223 (3) | 0.1596 (5) | 0.00784 (19) | 0.0870 (18) | |
| C8 | 0.5750 (3) | 0.2546 (5) | −0.03080 (15) | 0.0809 (15) | |
| C9 | 0.4775 (3) | 0.3064 (4) | −0.02935 (13) | 0.0663 (11) | |
| C10 | 0.4254 (3) | 0.2612 (3) | 0.01229 (12) | 0.0534 (10) | |
| C11 | 0.42742 (14) | 0.40923 (17) | −0.07152 (7) | 0.0932 (18) | |
| C12 | 0.35163 (14) | −0.33276 (17) | 0.19080 (7) | 0.0624 (11) | |
| C13 | 0.38060 (14) | −0.08820 (17) | 0.30121 (7) | 0.0547 (10) | |
| C14 | 0.12000 (14) | −0.14855 (17) | 0.20410 (7) | 0.0586 (10) | |
| H3A | 0.33496 | 0.35644 | 0.16190 | 0.0885* | |
| H3B | 0.26305 | 0.33584 | 0.10207 | 0.0885* | |
| H3C | 0.38277 | 0.36974 | 0.10716 | 0.0885* | |
| H4 | 0.42933 | 0.02018 | 0.10434 | 0.0511* | |
| H6 | 0.59915 | 0.04728 | 0.07422 | 0.0792* | |
| H7 | 0.68900 | 0.12660 | 0.00642 | 0.1042* | |
| H8 | 0.61025 | 0.28430 | −0.05866 | 0.0972* | |
| H10 | 0.35872 | 0.29454 | 0.01336 | 0.0640* | |
| H11A | 0.37070 | 0.45259 | −0.05805 | 0.1396* | |
| H11B | 0.40055 | 0.36550 | −0.10702 | 0.1396* | |
| H11C | 0.47878 | 0.47577 | −0.07662 | 0.1396* | |
| H12A | 0.30201 | −0.40592 | 0.18350 | 0.0935* | |
| H12B | 0.41411 | −0.36295 | 0.21610 | 0.0935* | |
| H12C | 0.36936 | −0.30341 | 0.15582 | 0.0935* | |
| H13A | 0.34336 | −0.01717 | 0.31612 | 0.0820* | |
| H13B | 0.44368 | −0.05221 | 0.29160 | 0.0820* | |
| H13C | 0.39864 | −0.15800 | 0.32919 | 0.0820* | |
| H14A | 0.09961 | −0.06049 | 0.21497 | 0.0879* | |
| H14B | 0.08599 | −0.21672 | 0.22256 | 0.0879* | |
| H14C | 0.09943 | −0.15869 | 0.16378 | 0.0879* |