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. 2009 Feb 11;65(Pt 3):o493. doi: 10.1107/S1600536809004115
x y z Uiso*/Ueq
N1 0.9325 (3) 0.15463 (10) 0.3804 (4) 0.0607 (7)
O1 0.9997 (3) 0.09590 (7) −0.0287 (2) 0.0536 (6)
O2 0.7379 (3) 0.04533 (8) −0.2839 (3) 0.0628 (6)
O3 0.3972 (3) 0.02973 (8) −0.2724 (3) 0.0640 (6)
C1 0.9412 (4) 0.13395 (11) 0.2492 (4) 0.0520 (8)
H1 1.0549 0.1351 0.2348 0.062*
C2 0.7898 (4) 0.10855 (10) 0.1187 (4) 0.0448 (7)
C3 0.8252 (4) 0.08912 (10) −0.0207 (4) 0.0451 (7)
C4 0.6955 (4) 0.06230 (10) −0.1484 (4) 0.0466 (7)
C5 0.5201 (4) 0.05545 (10) −0.1404 (4) 0.0481 (8)
C6 0.4808 (4) 0.07464 (11) −0.0057 (4) 0.0506 (8)
H6 0.3632 0.0698 −0.0019 0.061*
C7 0.6114 (4) 0.10096 (10) 0.1238 (4) 0.0512 (8)
C8 1.0063 (5) 0.13609 (12) −0.1356 (5) 0.0742 (11)
H8A 0.9214 0.1302 −0.2502 0.111*
H8B 1.1303 0.1393 −0.1350 0.111*
H8C 0.9717 0.1657 −0.0933 0.111*
C9 0.7579 (5) −0.00633 (14) −0.2860 (5) 0.0790 (11)
H9A 0.8493 −0.0169 −0.1793 0.119*
H9B 0.7973 −0.0154 −0.3777 0.119*
H9C 0.6408 −0.0217 −0.3023 0.119*
C10 0.2178 (4) 0.01986 (14) −0.2686 (4) 0.0737 (11)
H10A 0.2309 0.0048 −0.1617 0.111*
H10B 0.1515 −0.0018 −0.3607 0.111*
H10C 0.1499 0.0500 −0.2808 0.111*
C11 0.5545 (5) 0.11989 (13) 0.2664 (5) 0.0774 (11)
H11A 0.4251 0.1131 0.2402 0.116*
H11B 0.5749 0.1546 0.2779 0.116*
H11C 0.6275 0.1040 0.3715 0.116*
C12 1.0977 (4) 0.17428 (11) 0.5029 (4) 0.0501 (8)
C13 1.2692 (4) 0.15170 (11) 0.5499 (4) 0.0566 (9)
H13 1.2816 0.1228 0.4965 0.068*
C14 1.4218 (4) 0.17184 (12) 0.6755 (4) 0.0623 (9)
H14 1.5363 0.1562 0.7045 0.075*
C15 1.4108 (4) 0.21420 (12) 0.7595 (4) 0.0596 (9)
C16 1.2394 (5) 0.23596 (12) 0.7127 (4) 0.0678 (10)
H16 1.2272 0.2647 0.7668 0.081*
C17 1.0854 (5) 0.21645 (12) 0.5881 (4) 0.0653 (10)
H17 0.9708 0.2319 0.5607 0.078*
C18 1.5798 (5) 0.23466 (14) 0.8988 (5) 0.0950 (13)
H18A 1.6665 0.2465 0.8501 0.143*
H18B 1.6375 0.2094 0.9806 0.143*
H18C 1.5431 0.2612 0.9546 0.143*