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. 2012 Aug 11;68(Pt 9):o2679. doi: 10.1107/S1600536812034629
x y z Uiso*/Ueq
Cl1 −0.20822 (3) 0.54220 (12) 0.82496 (4) 0.08193 (19)
S1 0.39710 (3) 1.03306 (7) 1.11917 (3) 0.04855 (13)
O1 0.23806 (7) 0.8565 (2) 1.00294 (8) 0.0547 (3)
N1 0.53067 (8) 0.7454 (2) 1.08411 (8) 0.0444 (3)
N2 0.37558 (8) 0.6335 (2) 1.00962 (8) 0.0410 (2)
C1 0.51611 (12) 1.0855 (3) 1.16882 (11) 0.0530 (4)
H1A 0.5365 1.2115 1.2085 0.064*
C2 0.57568 (11) 0.9199 (3) 1.14263 (11) 0.0503 (3)
H2A 0.6429 0.9223 1.1626 0.060*
C3 0.43688 (9) 0.7846 (2) 1.06618 (8) 0.0370 (3)
C4 0.27847 (9) 0.6768 (2) 0.98005 (9) 0.0409 (3)
C5 0.22953 (11) 0.4817 (3) 0.91743 (12) 0.0508 (4)
H5A 0.2547 0.4902 0.8619 0.061*
H5B 0.2473 0.3248 0.9442 0.061*
C6 0.11993 (10) 0.4988 (2) 0.89603 (9) 0.0396 (3)
C7 0.06207 (10) 0.3160 (2) 0.92138 (9) 0.0425 (3)
H7A 0.0916 0.1835 0.9531 0.051*
C8 −0.03890 (11) 0.3270 (3) 0.90033 (10) 0.0458 (3)
H8A −0.0773 0.2037 0.9174 0.055*
C9 −0.08118 (10) 0.5259 (3) 0.85331 (9) 0.0457 (3)
C10 −0.02621 (11) 0.7100 (3) 0.82739 (9) 0.0501 (3)
H10A −0.0562 0.8422 0.7958 0.060*
C11 0.07454 (11) 0.6961 (3) 0.84901 (9) 0.0465 (3)
H11A 0.1124 0.8204 0.8319 0.056*
H1N2 0.4009 (14) 0.518 (3) 0.9827 (12) 0.052 (5)*