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. 2009 Nov 18;65(Pt 12):o3108. doi: 10.1107/S1600536809047990
x y z Uiso*/Ueq
S 0.68075 (8) 0.14488 (8) 0.16016 (6) 0.0423 (2)
F1 0.8904 (2) 0.0561 (2) −0.18276 (16) 0.0637 (5)
N1 0.6608 (3) 0.1922 (3) −0.07123 (19) 0.0475 (6)
C1 0.8942 (4) −0.3350 (4) −0.0851 (3) 0.0606 (9)
H1B 0.9319 −0.4285 −0.1078 0.073*
F2 0.6767 (2) −0.1812 (2) 0.14183 (15) 0.0616 (5)
N2 0.6037 (3) 0.3224 (3) −0.02139 (19) 0.0495 (6)
C2 0.9208 (3) −0.2061 (4) −0.1510 (3) 0.0531 (8)
H2B 0.9784 −0.2110 −0.2165 0.064*
N3 0.5574 (3) 0.4251 (3) 0.1678 (2) 0.0521 (7)
H3A 0.5209 0.5074 0.1338 0.062*
H3B 0.5620 0.4143 0.2462 0.062*
C3 0.8608 (3) −0.0705 (3) −0.1185 (2) 0.0442 (7)
C4 0.7736 (3) −0.0549 (3) −0.0209 (2) 0.0362 (6)
C5 0.7556 (3) −0.1889 (3) 0.0433 (3) 0.0446 (7)
C6 0.8123 (4) −0.3281 (3) 0.0144 (3) 0.0571 (8)
H6A 0.7961 −0.4149 0.0603 0.069*
C7 0.7062 (3) 0.0912 (3) 0.0101 (2) 0.0357 (6)
C8 0.6070 (3) 0.3142 (3) 0.0986 (2) 0.0376 (6)