x | y | z | Uiso*/Ueq | ||
O1 | 0.77782 (15) | 0.03007 (3) | 0.81600 (9) | 0.02023 (18) | |
N1 | 0.43265 (17) | −0.13343 (3) | 0.84671 (10) | 0.01613 (18) | |
N2 | 0.75959 (17) | −0.06091 (3) | 0.94759 (10) | 0.01473 (17) | |
C1 | 0.64511 (19) | −0.11546 (4) | 0.95755 (12) | 0.01455 (19) | |
C2 | 0.6596 (2) | −0.01885 (4) | 0.82081 (12) | 0.0158 (2) | |
C3 | 0.4232 (2) | −0.03768 (4) | 0.70385 (12) | 0.0169 (2) | |
C4 | 0.32239 (19) | −0.09370 (4) | 0.71759 (12) | 0.0156 (2) | |
C5 | 0.0868 (2) | −0.11656 (5) | 0.58916 (13) | 0.0190 (2) | |
C6 | 0.7737 (2) | −0.15603 (4) | 1.10544 (13) | 0.01614 (19) | |
C7 | 0.8468 (3) | −0.21559 (5) | 1.02578 (15) | 0.0249 (2) | |
C8 | 0.5752 (2) | −0.16347 (5) | 1.25028 (14) | 0.0222 (2) | |
H1N2 | 0.915 (3) | −0.0510 (7) | 1.0283 (19) | 0.034 (4)* | |
H3A | 0.338 (3) | −0.0101 (6) | 0.6146 (18) | 0.025 (3)* | |
H5A | −0.064 (3) | −0.1299 (6) | 0.655 (2) | 0.036 (4)* | |
H5B | 0.011 (3) | −0.0864 (7) | 0.503 (2) | 0.044 (4)* | |
H5C | 0.151 (3) | −0.1505 (6) | 0.5237 (19) | 0.034 (4)* | |
H6A | 0.946 (3) | −0.1369 (5) | 1.1613 (16) | 0.018 (3)* | |
H7A | 0.922 (3) | −0.2424 (6) | 1.124 (2) | 0.031 (3)* | |
H7B | 0.984 (3) | −0.2117 (6) | 0.9349 (19) | 0.031 (4)* | |
H7C | 0.681 (3) | −0.2348 (6) | 0.9648 (19) | 0.036 (4)* | |
H8A | 0.661 (3) | −0.1874 (6) | 1.3518 (19) | 0.029 (3)* | |
H8B | 0.408 (3) | −0.1849 (6) | 1.1978 (18) | 0.031 (4)* | |
H8C | 0.519 (3) | −0.1249 (6) | 1.2967 (19) | 0.032 (4)* |