| x | y | z | Uiso*/Ueq | ||
| O1 | 0.56019 (17) | 0.3078 (3) | 0.91644 (10) | 0.1025 (9) | |
| H1 | 0.559 (2) | 0.268 (6) | 0.959 (2) | 0.129 (13)* | |
| C2 | 0.61335 (11) | 0.1812 (3) | 0.86876 (9) | 0.0462 (4) | |
| H2A | 0.5895 | 0.0345 | 0.8663 | 0.055* | |
| H2B | 0.6727 | 0.1737 | 0.8919 | 0.055* | |
| C3 | 0.61828 (10) | 0.2752 (3) | 0.78509 (9) | 0.0383 (4) | |
| C4 | 0.57178 (10) | 0.1775 (3) | 0.72196 (8) | 0.0388 (4) | |
| H4 | 0.5385 | 0.0524 | 0.7316 | 0.047* | |
| C5 | 0.57476 (10) | 0.2651 (3) | 0.64505 (8) | 0.0375 (3) | |
| C6 | 0.62554 (10) | 0.4516 (3) | 0.62970 (9) | 0.0368 (3) | |
| C7 | 0.67100 (11) | 0.5504 (3) | 0.69227 (10) | 0.0452 (4) | |
| H7 | 0.7042 | 0.6757 | 0.6828 | 0.054* | |
| C8 | 0.66682 (11) | 0.4616 (3) | 0.76955 (9) | 0.0454 (4) | |
| H8 | 0.6973 | 0.5292 | 0.8116 | 0.054* | |
| O9 | 0.52924 (10) | 0.1784 (2) | 0.58164 (7) | 0.0554 (4) | |
| H9 | 0.498 (2) | 0.060 (6) | 0.5924 (18) | 0.124 (12)* | |
| O10 | 0.62581 (8) | 0.5189 (2) | 0.55089 (7) | 0.0472 (3) | |
| C11 | 0.67256 (15) | 0.7139 (3) | 0.53259 (12) | 0.0588 (5) | |
| H11A | 0.6682 | 0.7433 | 0.4757 | 0.088* | |
| H11B | 0.7341 | 0.6976 | 0.5473 | 0.088* | |
| H11C | 0.647 | 0.8328 | 0.5624 | 0.088* |