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. 2022 Jun 7;78(Pt 7):682–686. doi: 10.1107/S2056989022005643
x y z Uiso*/Ueq
O1 0.6355 (3) 0.48950 (8) 0.38804 (7) 0.0332 (3)
O2 1.0631 (3) 0.10838 (8) 0.62211 (7) 0.0336 (3)
O3 0.2117 (3) 0.11521 (8) 0.23777 (6) 0.0291 (3)
C1 0.6468 (4) 0.37799 (10) 0.40378 (8) 0.0214 (3)
C2 0.8207 (3) 0.34507 (10) 0.48515 (8) 0.0207 (3)
H2 0.9189 0.4000 0.5254 0.025*
C3 0.8496 (3) 0.23282 (10) 0.50697 (7) 0.0197 (3)
C4 0.7080 (4) 0.15111 (10) 0.44830 (8) 0.0214 (3)
H4 0.7294 0.0740 0.4631 0.026*
C5 0.5354 (3) 0.18440 (10) 0.36798 (8) 0.0206 (3)
C6 0.5036 (3) 0.29757 (10) 0.34512 (8) 0.0204 (3)
H6 0.3850 0.3191 0.2899 0.024*
C7 1.0363 (4) 0.20285 (11) 0.59351 (8) 0.0235 (3)
H7 1.1419 0.2615 0.6290 0.028*
C8 0.3862 (4) 0.09684 (11) 0.30752 (9) 0.0253 (3)
H8 0.4289 0.0210 0.3240 0.030*
H1 0.519 (7) 0.5065 (19) 0.3394 (16) 0.056 (7)*