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. 2009 Mar 25;65(Pt 4):o833–o834. doi: 10.1107/S1600536809009957
x y z Uiso*/Ueq
O1 0.17776 (17) 0.87567 (9) 1.02191 (10) 0.0328 (3)
O2 0.16471 (16) 1.01618 (9) 1.06678 (9) 0.0279 (3)
O3 0.45972 (17) 1.23529 (8) 0.87222 (10) 0.0312 (3)
O4 0.60603 (15) 1.20508 (8) 0.73223 (9) 0.0260 (3)
N1 0.62455 (17) 1.04202 (9) 0.66064 (10) 0.0176 (3)
N2 0.67704 (16) 0.97591 (9) 0.59199 (10) 0.0175 (3)
N3 0.21243 (18) 0.95518 (10) 1.00792 (10) 0.0228 (3)
N4 0.51408 (17) 1.18141 (9) 0.80690 (10) 0.0210 (3)
C1 0.47019 (19) 1.08784 (10) 0.81806 (11) 0.0167 (3)
C2 0.36357 (19) 1.06601 (10) 0.90212 (11) 0.0178 (3)
H2A 0.3226 1.1105 0.9469 0.021*
C3 0.3200 (2) 0.97796 (11) 0.91782 (11) 0.0180 (3)
C4 0.3812 (2) 0.90980 (11) 0.85198 (11) 0.0191 (3)
H4A 0.3528 0.8503 0.8653 0.023*
C5 0.4829 (2) 0.93102 (10) 0.76795 (11) 0.0177 (3)
H5A 0.5221 0.8854 0.7241 0.021*
C6 0.52995 (19) 1.02107 (10) 0.74630 (11) 0.0159 (3)
C7 0.74308 (19) 1.00482 (10) 0.50440 (11) 0.0169 (3)
C8 0.80349 (19) 0.93424 (10) 0.43032 (11) 0.0172 (3)
C9 0.7621 (2) 0.84429 (11) 0.44813 (12) 0.0208 (3)
H9A 0.6965 0.8292 0.5066 0.025*
C10 0.8168 (2) 0.77741 (11) 0.38063 (13) 0.0247 (4)
H10A 0.7869 0.7182 0.3943 0.030*
C11 0.9165 (2) 0.79729 (12) 0.29186 (12) 0.0223 (3)
C12 0.9582 (2) 0.88663 (12) 0.27404 (12) 0.0223 (3)
H12A 1.0245 0.9015 0.2158 0.027*
C13 0.9029 (2) 0.95450 (11) 0.34177 (11) 0.0198 (3)
H13A 0.9323 1.0138 0.3279 0.024*
C14 0.7563 (2) 1.10272 (11) 0.47653 (12) 0.0208 (3)
H14A 0.6455 1.1310 0.4853 0.031*
H14B 0.7899 1.1088 0.4037 0.031*
H14C 0.8418 1.1308 0.5229 0.031*
C15 0.9752 (2) 0.72351 (13) 0.21878 (14) 0.0298 (4)
H15A 0.8783 0.6855 0.2000 0.045*
H15B 1.0642 0.6887 0.2547 0.045*
H15C 1.0205 0.7494 0.1552 0.045*
H1N1 0.652 (3) 1.0963 (15) 0.6502 (15) 0.027 (5)*