Skip to main content
. 2021 Feb 19;77(Pt 3):282–285. doi: 10.1107/S2056989021001286
x y z Uiso*/Ueq
Cu1 0.60628 (6) 0.63056 (4) 0.41304 (4) 0.01841 (12)
O1 0.7261 (3) 0.5158 (2) 0.52799 (19) 0.0200 (5)
O2 0.9188 (3) 0.7153 (3) 0.3763 (2) 0.0247 (5)
H2O 0.931 (6) 0.635 (3) 0.346 (4) 0.037*
O3 0.7221 (3) 0.7944 (2) 0.5778 (2) 0.0241 (5)
O4 0.9916 (3) 0.5149 (2) 0.6990 (2) 0.0239 (5)
O5 1.2089 (3) 0.8062 (3) 0.7594 (2) 0.0296 (5)
H5O 1.178 (6) 0.869 (4) 0.813 (3) 0.044*
O6 0.9741 (4) 0.9263 (3) 0.7840 (2) 0.0337 (6)
N1 0.4537 (4) 0.7282 (3) 0.2933 (2) 0.0170 (5)
N2 0.4699 (4) 0.4750 (3) 0.2317 (2) 0.0166 (5)
C1 0.4522 (5) 0.8585 (3) 0.3373 (3) 0.0201 (6)
H1 0.5308 0.9116 0.4337 0.024*
C2 0.3410 (5) 0.9188 (3) 0.2483 (3) 0.0217 (7)
H2 0.3409 1.0109 0.2833 0.026*
C3 0.2293 (4) 0.8435 (3) 0.1071 (3) 0.0195 (6)
H3 0.1527 0.8836 0.0433 0.023*
C4 0.2309 (4) 0.7080 (3) 0.0597 (3) 0.0180 (6)
H4 0.1567 0.6548 −0.0372 0.022*
C5 0.3422 (4) 0.6519 (3) 0.1558 (3) 0.0142 (6)
C6 0.3512 (4) 0.5078 (3) 0.1208 (3) 0.0142 (6)
C7 0.2500 (4) 0.4119 (3) −0.0127 (3) 0.0155 (6)
H7 0.1676 0.4365 −0.0892 0.019*
C8 0.2703 (4) 0.2792 (3) −0.0335 (3) 0.0180 (6)
H8 0.2000 0.2107 −0.1239 0.022*
C9 0.3938 (5) 0.2480 (3) 0.0789 (3) 0.0191 (6)
H9 0.4109 0.1583 0.0665 0.023*
C10 0.4924 (4) 0.3482 (3) 0.2098 (3) 0.0180 (6)
H10 0.5788 0.3267 0.2866 0.022*
C11 0.9051 (5) 0.5800 (3) 0.6238 (3) 0.0217 (7)
C12 1.0222 (5) 0.7493 (4) 0.6426 (3) 0.0247 (7)
C13 0.8962 (5) 0.8297 (4) 0.6718 (3) 0.0258 (7)
C14 1.0784 (5) 0.7878 (4) 0.5103 (3) 0.0284 (7)
H14A 1.1263 0.8965 0.5195 0.034*
H14B 1.1917 0.7614 0.5117 0.034*