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. 2009 Oct 3;65(Pt 11):o2606–o2607. doi: 10.1107/S1600536809037611
x y z Uiso*/Ueq
O1 0.6301 (5) 0.4494 (2) 0.15286 (8) 0.0271 (6)
O2 0.7666 (5) 0.3298 (2) 0.10086 (7) 0.0237 (6)
O3 1.1545 (5) 0.4557 (2) 0.20322 (8) 0.0254 (6)
H3 1.2064 0.5245 0.2089 0.038*
O4 0.8720 (5) 0.5069 (2) 0.24884 (8) 0.0267 (6)
O5 0.6813 (5) 0.1857 (2) 0.28643 (7) 0.0230 (6)
O6 0.3240 (5) 0.2717 (2) 0.27449 (7) 0.0207 (6)
N1 0.6108 (6) 0.3053 (3) 0.22971 (9) 0.0221 (7)
H1 0.5004 0.3395 0.2147 0.027*
C1 0.8504 (7) 0.3115 (3) 0.21511 (11) 0.0203 (8)
H1A 0.9431 0.2511 0.2313 0.024*
C2 0.8711 (7) 0.2786 (3) 0.16889 (11) 0.0221 (8)
H2A 1.0385 0.2787 0.1610 0.027*
H2B 0.8106 0.1961 0.1648 0.027*
C3 0.7406 (7) 0.3629 (3) 0.14049 (11) 0.0205 (8)
C4 0.9549 (7) 0.4366 (3) 0.22432 (11) 0.0215 (8)
C5 0.6574 (8) 0.4001 (3) 0.06656 (11) 0.0254 (9)
C6 0.7397 (9) 0.3306 (4) 0.02814 (12) 0.0363 (11)
H6A 0.6839 0.2474 0.0298 0.054*
H6B 0.9110 0.3312 0.0270 0.054*
H6C 0.6768 0.3687 0.0030 0.054*
C7 0.7598 (8) 0.5265 (3) 0.06653 (13) 0.0309 (9)
H7A 0.9308 0.5216 0.0676 0.046*
H7B 0.7024 0.5706 0.0909 0.046*
H7C 0.7120 0.5685 0.0411 0.046*
C8 0.3951 (8) 0.3978 (4) 0.07039 (14) 0.0333 (10)
H8A 0.3481 0.4396 0.0959 0.050*
H8B 0.3410 0.3142 0.0715 0.050*
H8C 0.3253 0.4381 0.0462 0.050*
C9 0.5502 (7) 0.2491 (3) 0.26529 (11) 0.0180 (7)
C10 0.2379 (7) 0.2366 (3) 0.31542 (10) 0.0206 (8)
H10A 0.3663 0.2015 0.3322 0.025*
H10B 0.1125 0.1758 0.3126 0.025*
C11 0.1424 (7) 0.3503 (3) 0.33673 (11) 0.0199 (8)
H11 0.0232 0.3901 0.3185 0.024*
C12 0.0379 (7) 0.3219 (3) 0.37912 (11) 0.0231 (8)
C13 −0.1547 (8) 0.2505 (3) 0.38905 (11) 0.0243 (8)
H13 −0.2397 0.2099 0.3679 0.029*
C14 −0.2195 (7) 0.2401 (3) 0.43060 (12) 0.0263 (9)
H14 −0.3507 0.1918 0.4378 0.032*
C15 −0.0960 (8) 0.2990 (3) 0.46202 (12) 0.0284 (9)
H15 −0.1433 0.2903 0.4902 0.034*
C16 0.0969 (7) 0.3707 (3) 0.45224 (12) 0.0261 (9)
H16 0.1830 0.4103 0.4735 0.031*
C17 0.1598 (8) 0.3825 (3) 0.41070 (11) 0.0227 (8)
C18 0.3500 (7) 0.4533 (3) 0.39111 (11) 0.0220 (8)
C19 0.5228 (8) 0.5253 (3) 0.40880 (12) 0.0286 (9)
H19 0.5306 0.5365 0.4381 0.034*
C20 0.6843 (8) 0.5807 (3) 0.38242 (13) 0.0302 (10)
H20 0.8067 0.6279 0.3940 0.036*
C21 0.6685 (8) 0.5678 (3) 0.33946 (13) 0.0289 (9)
H21 0.7788 0.6072 0.3220 0.035*
C22 0.4919 (8) 0.4973 (3) 0.32146 (12) 0.0250 (8)
H22 0.4792 0.4901 0.2920 0.030*
C23 0.3357 (7) 0.4382 (3) 0.34766 (11) 0.0230 (8)