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. 2020 Oct 9;76(Pt 11):1725–1727. doi: 10.1107/S2056989020012955
x y z Uiso*/Ueq
Au1 0.75297 (2) −0.00058 (2) 0.64453 (2) 0.01001 (2)
O1 0.4872 (2) 0.22687 (7) 0.35894 (15) 0.0181 (3)
O4 1.0437 (3) −0.20014 (8) 0.49251 (17) 0.0272 (4)
O3 0.9998 (2) −0.20622 (7) 0.28226 (15) 0.0170 (3)
O2 0.4569 (3) 0.20965 (8) 0.56671 (17) 0.0271 (4)
N6 0.7546 (3) 0.04933 (9) 0.88472 (19) 0.0213 (4)
N1 0.8122 (3) −0.04540 (8) 0.48884 (17) 0.0141 (4)
N5 0.6697 (3) 0.05028 (8) 0.78531 (18) 0.0180 (4)
N4 0.7094 (4) −0.07941 (11) 0.9575 (2) 0.0327 (5)
N2 0.8539 (3) −0.06048 (8) 0.76482 (18) 0.0173 (4)
N7 0.8264 (4) 0.05242 (11) 0.9828 (2) 0.0346 (6)
N3 0.7753 (3) −0.06848 (9) 0.86238 (19) 0.0211 (4)
C1 0.6763 (3) 0.05386 (8) 0.50946 (19) 0.0097 (4)
C2 0.6095 (3) 0.10502 (9) 0.5321 (2) 0.0144 (4)
H2 0.591225 0.116874 0.616458 0.017*
C6 0.7021 (3) 0.03570 (9) 0.3866 (2) 0.0119 (4)
C7 0.7724 (3) −0.01977 (9) 0.3753 (2) 0.0120 (4)
C10 0.9087 (3) −0.12530 (9) 0.3809 (2) 0.0135 (4)
C12 0.4984 (3) 0.19541 (9) 0.4620 (2) 0.0164 (4)
C9 0.8673 (3) −0.10048 (9) 0.2653 (2) 0.0156 (4)
H9 0.885418 −0.119718 0.188635 0.019*
C8 0.7995 (3) −0.04760 (9) 0.2623 (2) 0.0152 (4)
H8 0.771619 −0.030465 0.183738 0.018*
C5 0.6615 (3) 0.07016 (9) 0.2849 (2) 0.0159 (4)
H5 0.679171 0.058026 0.200723 0.019*
C17 0.9570 (4) −0.30317 (11) 0.3331 (3) 0.0324 (6)
H17A 0.835596 −0.301253 0.287316 0.049*
H17B 0.936999 −0.297241 0.423392 0.049*
H17C 1.013575 −0.339051 0.320534 0.049*
C4 0.5950 (3) 0.12224 (9) 0.3074 (2) 0.0161 (4)
H4 0.567987 0.145929 0.238554 0.019*
C3 0.5680 (3) 0.13978 (9) 0.4310 (2) 0.0139 (4)
C16 1.0875 (3) −0.26013 (9) 0.2839 (2) 0.0194 (5)
H16A 1.203416 −0.259024 0.337608 0.023*
H16B 1.124940 −0.269813 0.197057 0.023*
C15 0.9899 (3) −0.18128 (9) 0.3932 (2) 0.0156 (4)
C13 0.4230 (4) 0.28268 (10) 0.3779 (2) 0.0220 (5)
H13A 0.324410 0.283170 0.443070 0.026*
H13B 0.366153 0.296654 0.298177 0.026*
C11 0.8795 (3) −0.09698 (9) 0.4924 (2) 0.0140 (4)
H11 0.906730 −0.113793 0.571430 0.017*
C14 0.5832 (4) 0.31882 (11) 0.4186 (3) 0.0338 (7)
H14A 0.678520 0.319531 0.352664 0.051*
H14B 0.640129 0.304889 0.497250 0.051*
H14C 0.535687 0.355673 0.432548 0.051*