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. 2007 Dec 6;64(Pt 1):o148. doi: 10.1107/S1600536807063052
x y z Uiso*/Ueq
Br 0.53020 (5) 0.73216 (4) −0.179068 (16) 0.06373 (10)
S −0.30384 (12) 0.86959 (6) 0.21002 (5) 0.05180 (16)
O 0.0436 (3) 0.53588 (14) 0.23230 (12) 0.0412 (4)
C1 −0.1770 (4) 0.7187 (3) 0.23497 (15) 0.0404 (5)
C2 −0.2370 (5) 0.6414 (2) 0.31587 (17) 0.0407 (5)
C3 −0.3917 (5) 0.6547 (2) 0.39043 (19) 0.0470 (6)
H3 −0.4889 0.7271 0.3946 0.056*
C4 −0.3984 (5) 0.5590 (2) 0.45776 (18) 0.0455 (5)
C5 −0.2494 (5) 0.4511 (2) 0.44955 (17) 0.0450 (5)
H5 −0.2559 0.3878 0.4960 0.054*
C6 −0.0931 (4) 0.4327 (2) 0.37673 (17) 0.0410 (5)
C7 −0.0959 (4) 0.5314 (2) 0.31082 (17) 0.0398 (5)
C8 −0.0091 (4) 0.6519 (2) 0.18701 (16) 0.0404 (5)
C9 0.1192 (5) 0.6724 (2) 0.10053 (18) 0.0404 (5)
C10 0.3069 (5) 0.5879 (2) 0.07758 (18) 0.0468 (5)
H10 0.3491 0.5187 0.1182 0.056*
C11 0.4310 (5) 0.6059 (2) −0.00479 (19) 0.0510 (6)
H11 0.5568 0.5498 −0.0190 0.061*
C12 0.3659 (5) 0.7077 (2) −0.06535 (17) 0.0465 (6)
C13 0.1811 (5) 0.7927 (3) −0.04460 (19) 0.0527 (6)
H13 0.1395 0.8613 −0.0859 0.063*
C14 0.0585 (5) 0.7753 (2) 0.03788 (19) 0.0491 (6)
H14 −0.0655 0.8326 0.0518 0.059*
C15 −0.5633 (5) 0.5692 (3) 0.5390 (2) 0.0598 (7)
H15A −0.7403 0.5805 0.5105 0.072*
H15B −0.5081 0.6398 0.5803 0.072*
H15C −0.5471 0.4940 0.5780 0.072*
C16 0.0696 (5) 0.3184 (2) 0.3687 (2) 0.0533 (6)
H16A 0.0178 0.2785 0.3060 0.080*
H16B 0.0473 0.2611 0.4212 0.080*
H16C 0.2478 0.3424 0.3739 0.080*
C17 −0.0310 (6) 0.9643 (3) 0.2543 (3) 0.0748 (10)
H17A −0.0756 1.0512 0.2448 0.112*
H17B 0.1087 0.9444 0.2183 0.112*
H17C 0.0207 0.9483 0.3235 0.112*