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. 2011 Aug 27;67(Pt 9):o2413. doi: 10.1107/S1600536811033952
x y z Uiso*/Ueq
S1 0.48563 (8) 0.37379 (7) 0.18859 (4) 0.02226 (18)
O1 0.0046 (3) 0.9832 (3) 0.65011 (15) 0.0430 (6)
O2 0.0293 (3) 0.7834 (3) 0.74650 (13) 0.0364 (5)
N1 0.3673 (3) 0.5040 (3) 0.33704 (14) 0.0184 (4)
N2 0.3841 (3) 0.2469 (3) 0.34126 (15) 0.0227 (5)
N3 0.3212 (3) 0.2888 (3) 0.41922 (14) 0.0227 (5)
N4 0.0471 (3) 0.8436 (3) 0.67295 (14) 0.0265 (5)
C1 0.4131 (3) 0.3742 (3) 0.29010 (16) 0.0192 (5)
C2 0.3128 (3) 0.4479 (3) 0.41483 (16) 0.0187 (5)
C3 0.2506 (3) 0.5522 (3) 0.48290 (16) 0.0186 (5)
C4 0.2100 (3) 0.4814 (3) 0.56284 (16) 0.0206 (5)
H4A 0.2269 0.3680 0.5738 0.025*
C5 0.1450 (3) 0.5774 (3) 0.62606 (16) 0.0218 (5)
H5A 0.1165 0.5310 0.6805 0.026*
C6 0.1226 (3) 0.7419 (3) 0.60807 (16) 0.0223 (5)
C7 0.1638 (3) 0.8162 (3) 0.53043 (17) 0.0235 (5)
H7A 0.1490 0.9301 0.5208 0.028*
C8 0.2272 (3) 0.7193 (3) 0.46708 (16) 0.0210 (5)
H8A 0.2548 0.7668 0.4127 0.025*
H1N1 0.384 (4) 0.601 (4) 0.323 (2) 0.026 (8)*
H1N2 0.400 (4) 0.154 (4) 0.329 (2) 0.033 (9)*