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. 2009 Nov 28;65(Pt 12):o3224. doi: 10.1107/S1600536809050363
x y z Uiso*/Ueq
S1 0.06340 (2) 0.12898 (6) 0.26302 (3) 0.02887 (10)
O1 0.08669 (8) 0.1945 (2) 0.34378 (7) 0.0408 (3)
O2 0.03981 (7) −0.10715 (19) 0.24877 (8) 0.0384 (3)
C1 −0.01788 (10) 0.3229 (3) 0.23092 (10) 0.0276 (3)
H1 0.0034 0.4820 0.2409 0.033*
C2 −0.03155 (9) 0.3073 (3) 0.14009 (10) 0.0272 (3)
C3 −0.06491 (11) 0.1160 (3) 0.10143 (11) 0.0347 (4)
H3 −0.0816 −0.0139 0.1324 0.042*
C4 −0.07391 (11) 0.1141 (3) 0.01781 (12) 0.0405 (4)
H4 −0.0964 −0.0180 −0.0080 0.049*
C5 −0.05082 (12) 0.2999 (4) −0.02807 (12) 0.0428 (4)
H5 −0.0576 0.2970 −0.0853 0.051*
C6 −0.01740 (12) 0.4927 (4) 0.00955 (13) 0.0451 (5)
H6 −0.0008 0.6218 −0.0218 0.054*
C7 −0.00847 (11) 0.4955 (3) 0.09276 (11) 0.0363 (4)
H7 0.0138 0.6283 0.1182 0.044*
C8 −0.09145 (10) 0.2969 (3) 0.28610 (9) 0.0304 (4)
C9 −0.14154 (12) 0.1021 (3) 0.28814 (12) 0.0431 (4)
H9 −0.1290 −0.0274 0.2551 0.052*
C10 −0.20970 (13) 0.0971 (4) 0.33832 (13) 0.0500 (5)
H10 −0.2444 −0.0343 0.3383 0.060*
C11 −0.22748 (13) 0.2805 (4) 0.38811 (13) 0.0531 (5)
H11 −0.2740 0.2751 0.4227 0.064*
C12 −0.17763 (14) 0.4719 (4) 0.38771 (14) 0.0547 (5)
H12 −0.1895 0.5985 0.4223 0.066*
C13 −0.10994 (12) 0.4802 (3) 0.33668 (11) 0.0406 (4)
H13 −0.0760 0.6133 0.3365 0.049*
C14 0.14411 (10) 0.2005 (3) 0.19613 (10) 0.0292 (3)
C15 0.18653 (11) 0.4044 (3) 0.20890 (12) 0.0407 (4)
H15 0.1739 0.5002 0.2539 0.049*
C16 0.24784 (12) 0.4662 (3) 0.15468 (14) 0.0479 (5)
H16 0.2775 0.6055 0.1623 0.057*
C17 0.26549 (12) 0.3259 (4) 0.09010 (13) 0.0503 (5)
H17 0.3075 0.3691 0.0532 0.060*
C18 0.22315 (13) 0.1231 (4) 0.07798 (14) 0.0517 (5)
H18 0.2364 0.0267 0.0333 0.062*
C19 0.16122 (12) 0.0598 (3) 0.13093 (12) 0.0403 (4)
H19 0.1311 −0.0782 0.1224 0.048*