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. 2020 Apr 9;76(Pt 5):646–650. doi: 10.1107/S2056989020004648
x y z Uiso*/Ueq
O1 0.96864 (7) 0.23821 (16) 0.65434 (3) 0.01577 (17)
O2 0.26072 (7) 0.95788 (18) 0.47532 (3) 0.01982 (18)
O3 0.09239 (7) 0.7586 (2) 0.49784 (4) 0.0246 (2)
N1 1.02983 (8) 0.66732 (19) 0.66764 (4) 0.01464 (18)
H1 1.0072 (13) 0.834 (3) 0.6656 (6) 0.018*
C1 1.35763 (10) 0.7868 (2) 0.69502 (4) 0.0179 (2)
H1A 1.387593 0.633931 0.677037 0.021*
H1AB 1.404140 0.946479 0.688562 0.021*
C2 1.37316 (10) 0.7289 (2) 0.75164 (4) 0.0177 (2)
H2A 1.456652 0.689410 0.763536 0.021*
H2AB 1.350298 0.887869 0.770054 0.021*
C3 1.29754 (11) 0.4914 (2) 0.76259 (4) 0.0184 (2)
H3A 1.306633 0.458942 0.799445 0.022*
H3AB 1.324548 0.329830 0.746168 0.022*
C4 1.16802 (10) 0.5412 (2) 0.74321 (4) 0.0174 (2)
H4A 1.121475 0.381401 0.749567 0.021*
H4AB 1.139004 0.693282 0.761708 0.021*
C5 1.15165 (9) 0.6024 (2) 0.68667 (4) 0.01204 (19)
H5 1.174757 0.440743 0.668389 0.014*
C6 1.22876 (10) 0.8346 (2) 0.67461 (4) 0.0156 (2)
H6A 1.201602 1.000303 0.689604 0.019*
H6AB 1.220984 0.859459 0.637563 0.019*
C7 0.13448 (10) 0.9561 (2) 0.46564 (4) 0.0178 (2)
H00F 0.103160 1.134167 0.472821 0.021*
H00G 0.108313 0.912274 0.429779 0.021*
C8 0.29070 (10) 0.7663 (2) 0.51139 (4) 0.0146 (2)
C9 0.19016 (9) 0.6451 (2) 0.52444 (4) 0.0157 (2)
C10 0.19552 (10) 0.4395 (2) 0.55871 (4) 0.0172 (2)
H10 0.126694 0.356487 0.567425 0.021*
C11 0.30804 (10) 0.3586 (2) 0.58014 (4) 0.0154 (2)
H11 0.315407 0.213891 0.603318 0.018*
C12 0.40980 (9) 0.4841 (2) 0.56850 (4) 0.0135 (2)
C13 0.40115 (9) 0.6936 (2) 0.53284 (4) 0.0142 (2)
H13 0.469038 0.780458 0.524074 0.017*
C14 0.52399 (9) 0.3949 (2) 0.59388 (4) 0.0151 (2)
H14 0.528504 0.219194 0.607404 0.018*
C15 0.62312 (9) 0.5413 (2) 0.59963 (4) 0.0153 (2)
H15 0.618873 0.720765 0.588024 0.018*
C16 0.73553 (9) 0.4407 (2) 0.62246 (4) 0.0144 (2)
H16 0.741526 0.256496 0.630909 0.017*
C17 0.83199 (9) 0.5927 (2) 0.63240 (4) 0.0147 (2)
H17 0.825437 0.779183 0.626212 0.018*
C18 0.94810 (9) 0.4819 (2) 0.65259 (4) 0.01252 (19)