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. 2013 Aug 7;69(Pt 9):o1385. doi: 10.1107/S1600536813019752
x y z Uiso*/Ueq
C1 −0.4336 (10) −0.1420 (8) 0.7590 (3) 0.0265 (11)
C2 −0.2429 (10) −0.1841 (9) 0.7200 (3) 0.0264 (12)
H2 −0.1959 −0.3079 0.7159 0.032*
C3 −0.1322 (9) −0.0462 (8) 0.6895 (3) 0.0258 (12)
H3 −0.1824 0.0764 0.6946 0.031*
C4 0.0617 (10) −0.0763 (7) 0.6489 (3) 0.0235 (11)
C5 0.1860 (10) 0.0569 (8) 0.6186 (3) 0.0222 (11)
H5 0.1553 0.1849 0.6203 0.027*
C6 0.3668 (10) −0.0199 (8) 0.5843 (3) 0.0241 (12)
C7 0.3838 (8) −0.2120 (7) 0.5887 (2) 0.0191 (11)
C8 0.5528 (11) −0.3400 (7) 0.5583 (3) 0.0264 (12)
H8A 0.5059 −0.3791 0.5142 0.040*
H8B 0.5713 −0.4485 0.5865 0.040*
H8C 0.6888 −0.2741 0.5546 0.040*
N1 −0.5883 (9) −0.1203 (8) 0.7912 (3) 0.0331 (11)
S1 0.1701 (3) −0.2987 (2) 0.63524 (7) 0.0246 (3)
Br1 0.57000 (10) 0.12692 (8) 0.53635 (3) 0.0319 (2)