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. 2024 Mar 28;80(Pt 4):435–438. doi: 10.1107/S2056989024002676
x y z Uiso*/Ueq
C1 0.0359 (3) 0.5721 (2) 0.51241 (15) 0.0281 (3)
H1 −0.031345 0.684945 0.481716 0.034*
C2 0.2167 (3) 0.55372 (19) 0.58634 (13) 0.0233 (3)
C3 0.3159 (3) 0.69811 (19) 0.60246 (13) 0.0227 (3)
C4 0.4711 (3) 0.6807 (2) 0.67872 (13) 0.0231 (3)
H4 0.530524 0.782718 0.687774 0.028*
C5 0.5389 (3) 0.5136 (2) 0.74157 (13) 0.0228 (3)
C6 0.4506 (3) 0.36589 (19) 0.72551 (13) 0.0232 (3)
C7 0.2901 (3) 0.3868 (2) 0.65094 (14) 0.0240 (3)
H7 0.228245 0.284508 0.643620 0.029*
N1 0.2610 (2) 0.88106 (17) 0.53758 (12) 0.0251 (3)
O1 0.2657 (2) 0.99488 (15) 0.58698 (11) 0.0322 (3)
O2 0.2220 (2) 0.91252 (15) 0.43721 (11) 0.0326 (3)
C8 0.6966 (3) 0.50015 (19) 0.82811 (13) 0.0232 (3)
O3 0.8602 (2) 0.59305 (14) 0.80816 (10) 0.0283 (3)
O4 0.62797 (19) 0.37663 (14) 0.93005 (9) 0.0258 (3)
C9 0.7826 (3) 0.3411 (2) 1.01503 (15) 0.0302 (4)
H9A 0.933156 0.306373 0.979732 0.045*
H9B 0.722258 0.245232 1.085262 0.045*
H9C 0.796944 0.447755 1.037561 0.045*
C10 0.5267 (3) 0.1811 (2) 0.78464 (14) 0.0259 (3)
O5 0.3990 (2) 0.05833 (16) 0.82506 (13) 0.0407 (3)
O6 0.75063 (19) 0.17046 (14) 0.78393 (10) 0.0261 (3)
C11 0.8374 (3) −0.0025 (2) 0.84384 (17) 0.0332 (4)
H11A 0.806798 −0.087882 0.804802 0.050*
H11B 0.761355 −0.039755 0.926402 0.050*
H11C 1.002594 0.003374 0.840751 0.050*