x | y | z | Uiso*/Ueq | ||
O1 | 0.08845 (8) | 0.19504 (17) | 0.44462 (6) | 0.0505 (3) | |
O3 | 0.36752 (8) | 0.39585 (19) | 0.41680 (7) | 0.0567 (3) | |
C9 | 0.02550 (11) | 0.3708 (2) | 0.40435 (8) | 0.0426 (3) | |
C2 | 0.25245 (11) | 0.3964 (2) | 0.40998 (9) | 0.0466 (3) | |
C3 | 0.19407 (11) | 0.5719 (2) | 0.37284 (8) | 0.0455 (3) | |
H3 | 0.2298 | 0.6985 | 0.3497 | 0.055* | |
C4 | 0.07494 (11) | 0.5644 (2) | 0.36879 (8) | 0.0420 (3) | |
C8 | −0.08834 (12) | 0.3450 (3) | 0.40123 (9) | 0.0521 (3) | |
H8 | −0.1198 | 0.2150 | 0.4258 | 0.063* | |
C1 | 0.20130 (12) | 0.1982 (2) | 0.45088 (9) | 0.0492 (3) | |
O4 | 0.36176 (9) | 0.1032 (2) | 0.31915 (8) | 0.0683 (3) | |
O2 | 0.24985 (10) | 0.0406 (2) | 0.48893 (8) | 0.0695 (3) | |
C5 | 0.00553 (12) | 0.7361 (2) | 0.32863 (9) | 0.0497 (3) | |
H5 | 0.0362 | 0.8676 | 0.3045 | 0.060* | |
C6 | −0.10727 (13) | 0.7114 (3) | 0.32463 (10) | 0.0566 (4) | |
H6 | −0.1527 | 0.8257 | 0.2975 | 0.068* | |
C7 | −0.15398 (12) | 0.5169 (3) | 0.36080 (10) | 0.0567 (4) | |
H7 | −0.2306 | 0.5022 | 0.3578 | 0.068* | |
C10 | 0.41542 (12) | 0.2272 (3) | 0.36892 (10) | 0.0530 (3) | |
C11 | 0.53858 (13) | 0.2315 (4) | 0.38698 (13) | 0.0728 (5) | |
H11A | 0.5644 | 0.3905 | 0.3808 | 0.087* | |
H11B | 0.5576 | 0.1839 | 0.4471 | 0.087* | |
C12 | 0.59736 (16) | 0.0768 (5) | 0.32791 (15) | 0.0858 (6) | |
H12A | 0.6758 | 0.0871 | 0.3428 | 0.129* | |
H12B | 0.5806 | 0.1252 | 0.2683 | 0.129* | |
H12C | 0.5736 | −0.0817 | 0.3346 | 0.129* |