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. 2025 Jun 6;81(Pt 7):569–572. doi: 10.1107/S2056989025004980
x y z Uiso*/Ueq
S1 0.18439 (4) 0.24766 (7) 0.46938 (4) 0.04704 (14)
S2 0.34737 (4) 0.41561 (7) 0.71120 (4) 0.04642 (14)
S3 0.61254 (5) 0.45960 (7) 0.67293 (6) 0.05644 (16)
N1 0.10297 (15) 0.3506 (3) 0.65446 (15) 0.0558 (4)
N2 −0.00530 (15) 0.2958 (3) 0.56825 (16) 0.0591 (5)
N3 0.46784 (15) 0.2117 (2) 0.57237 (16) 0.0497 (4)
C1 0.20708 (15) 0.3340 (2) 0.61488 (15) 0.0384 (3)
C2 0.02170 (17) 0.2417 (3) 0.46812 (17) 0.0449 (4)
C3 0.47049 (15) 0.3452 (2) 0.64267 (14) 0.0358 (3)
C4 0.67326 (17) 0.3165 (3) 0.58452 (17) 0.0460 (4)
H4 0.756109 0.320593 0.570753 0.055*
C5 0.58447 (17) 0.1979 (3) 0.53809 (18) 0.0479 (4)
H5 0.599905 0.110958 0.485673 0.058*
C6 −0.07813 (19) 0.1783 (4) 0.3609 (2) 0.0606 (6)
H6A −0.089445 0.261709 0.295572 0.091*
H6B −0.158370 0.162416 0.384862 0.091*
H6C −0.050886 0.069815 0.333151 0.091*