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. 2009 Feb 21;65(Pt 3):o558. doi: 10.1107/S1600536809005418
x y z Uiso*/Ueq
O1 1.0523 (2) 0.3714 (2) 0.40317 (15) 0.0487 (7)
O2 1.0082 (3) 0.1757 (2) 0.38640 (16) 0.0563 (7)
O3 0.7178 (3) 0.5462 (3) 0.32890 (18) 0.0746 (10)
O4 0.7681 (3) 0.3835 (3) 0.39767 (17) 0.0627 (8)
O5 0.8037 (2) 0.4291 (2) 0.03763 (13) 0.0404 (6)
O6 0.9697 (2) 0.2550 (2) 0.05972 (14) 0.0408 (6)
N1 0.7693 (3) 0.4455 (3) 0.33404 (18) 0.0445 (8)
N2 0.6436 (2) 0.7187 (2) −0.17424 (16) 0.0314 (6)
C1 1.1303 (4) 0.3499 (4) 0.4829 (2) 0.0633 (12)
H1A 1.1646 0.4247 0.5061 0.095*
H1B 1.2035 0.2973 0.4756 0.095*
H1C 1.0748 0.3134 0.5199 0.095*
C2 0.9964 (3) 0.2764 (3) 0.3627 (2) 0.0395 (8)
C3 0.9287 (3) 0.3122 (3) 0.27838 (19) 0.0325 (7)
C4 0.9752 (3) 0.2621 (3) 0.20979 (19) 0.0310 (7)
H4A 1.0391 0.2015 0.2174 0.037*
C5 0.9293 (3) 0.2995 (3) 0.13026 (19) 0.0303 (7)
C6 0.8349 (3) 0.3941 (3) 0.1185 (2) 0.0328 (7)
C7 0.7857 (3) 0.4424 (3) 0.18563 (19) 0.0316 (7)
H7A 0.7229 0.5039 0.1782 0.038*
C8 0.8291 (3) 0.4000 (3) 0.26530 (19) 0.0323 (7)
C9 1.0556 (4) 0.1520 (3) 0.0662 (2) 0.0520 (10)
H9A 1.0762 0.1303 0.0118 0.078*
H9B 1.0112 0.0863 0.0896 0.078*
H9C 1.1368 0.1706 0.1016 0.078*
C10 0.7202 (3) 0.5334 (3) 0.0212 (2) 0.0368 (8)
H10A 0.7556 0.5999 0.0560 0.044*
H10B 0.6301 0.5165 0.0332 0.044*
C11 0.7190 (3) 0.5643 (3) −0.0687 (2) 0.0380 (8)
H11A 0.6879 0.4957 −0.1027 0.046*
H11B 0.8094 0.5827 −0.0796 0.046*
C12 0.6288 (3) 0.6713 (3) −0.0931 (2) 0.0404 (8)
H12A 0.5364 0.6474 −0.0922 0.048*
H12B 0.6488 0.7343 −0.0519 0.048*
C13 0.5908 (4) 0.6370 (3) −0.2416 (2) 0.0462 (9)
H13A 0.4957 0.6258 −0.2401 0.055*
H13B 0.6340 0.5595 −0.2326 0.055*
C14 0.6130 (5) 0.6835 (4) −0.3253 (2) 0.0601 (11)
H14A 0.5713 0.6294 −0.3679 0.072*
H14B 0.7083 0.6848 −0.3293 0.072*
C15 0.5571 (4) 0.8070 (4) −0.3413 (2) 0.0618 (11)
H15A 0.4602 0.8042 −0.3471 0.074*
H15B 0.5837 0.8382 −0.3928 0.074*
C16 0.6085 (4) 0.8881 (3) −0.2698 (2) 0.0509 (10)
H16A 0.5661 0.9661 −0.2779 0.061*
H16B 0.7041 0.8991 −0.2691 0.061*
C17 0.5809 (4) 0.8370 (3) −0.1868 (2) 0.0431 (9)
H17A 0.6163 0.8905 −0.1421 0.052*
H17B 0.4851 0.8299 −0.1860 0.052*