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. 2012 Oct 20;68(Pt 11):o3151–o3152. doi: 10.1107/S1600536812041359
x y z Uiso*/Ueq
O1 0.37734 (6) 0.60282 (6) 0.39711 (6) 0.01806 (13)
O2 0.80810 (7) 0.48126 (7) 0.29773 (7) 0.02633 (15)
O3 0.79587 (6) 0.45930 (6) 0.48584 (7) 0.02282 (14)
N1 0.55569 (6) 0.55843 (7) 0.37336 (7) 0.01512 (13)
N2 0.02845 (7) 0.72276 (7) 0.43791 (7) 0.01818 (14)
N3 0.14291 (7) 0.77377 (8) 0.32695 (8) 0.02345 (16)
C1 0.43630 (7) 0.61584 (7) 0.33157 (8) 0.01518 (14)
C2 0.38707 (8) 0.68852 (8) 0.21019 (8) 0.02096 (16)
H2A 0.3064 0.7328 0.1776 0.025*
C3 0.45395 (9) 0.69519 (10) 0.14089 (9) 0.02493 (18)
H3A 0.4195 0.7439 0.0608 0.030*
C4 0.57443 (9) 0.63000 (9) 0.18740 (9) 0.02318 (17)
H4A 0.6203 0.6326 0.1382 0.028*
C5 0.62317 (8) 0.56351 (8) 0.30428 (8) 0.01706 (15)
C6 0.75338 (8) 0.49530 (8) 0.36664 (9) 0.01855 (15)
C7 −0.25015 (10) 0.86990 (10) 0.46610 (12) 0.0311 (2)
H7A −0.2490 0.7998 0.5234 0.047*
H7B −0.3361 0.8737 0.3856 0.047*
H7C −0.2328 0.9509 0.5149 0.047*
C8 −0.14653 (8) 0.84727 (8) 0.42693 (9) 0.02107 (16)
C9 −0.12821 (9) 0.93128 (9) 0.34046 (10) 0.02358 (17)
H9A −0.1834 1.0039 0.3055 0.028*
C10 −0.03306 (9) 0.91053 (9) 0.30608 (9) 0.02217 (17)
H10A −0.0219 0.9685 0.2486 0.027*
C11 0.04861 (7) 0.80162 (8) 0.35711 (8) 0.01760 (15)
C12 −0.06528 (8) 0.74369 (8) 0.47303 (8) 0.01970 (16)
H12A −0.0746 0.6849 0.5310 0.024*
H1N1 0.5904 (14) 0.5129 (15) 0.4496 (14) 0.033 (3)*
H2N3 0.1961 (15) 0.7063 (15) 0.3644 (15) 0.037 (4)*
H1N3 0.1663 (14) 0.8348 (15) 0.2824 (14) 0.034 (3)*
H1N2 0.0830 (15) 0.6489 (15) 0.4686 (16) 0.040 (4)*