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. 2012 Aug 15;68(Pt 9):o2710. doi: 10.1107/S1600536812035167
x y z Uiso*/Ueq
O1 0.7861 (3) 0.24084 (11) −0.0065 (2) 0.0216 (6)
O2 0.8041 (3) 0.28421 (11) 0.3142 (2) 0.0235 (6)
N1 0.4493 (3) 0.26282 (13) −0.0175 (2) 0.0195 (7)
N2 1.0989 (4) 0.21659 (13) 0.3653 (2) 0.0220 (7)
C1 0.6269 (4) 0.22638 (15) 0.0296 (3) 0.0171 (7)
C2 0.6276 (4) 0.16096 (14) 0.1249 (3) 0.0168 (7)
C3 0.5027 (4) 0.10057 (15) 0.0751 (3) 0.0189 (7)
C4 0.5113 (4) 0.03795 (16) 0.1583 (3) 0.0235 (8)
C5 0.6447 (4) 0.03548 (15) 0.2915 (3) 0.0211 (8)
C6 0.7738 (4) 0.09499 (15) 0.3414 (3) 0.0200 (7)
C7 0.7675 (4) 0.15789 (14) 0.2577 (3) 0.0171 (7)
C8 0.8934 (4) 0.22495 (16) 0.3135 (3) 0.0189 (7)
C9 0.4327 (5) 0.32006 (16) −0.1231 (3) 0.0244 (8)
C10 0.2644 (4) 0.25242 (16) 0.0331 (3) 0.0232 (8)
C11 1.2112 (4) 0.14818 (17) 0.3610 (3) 0.0261 (8)
C12 1.2221 (5) 0.27854 (19) 0.4338 (3) 0.0312 (9)
O3 0.1819 (3) 0.12996 (12) 0.7353 (2) 0.0259 (6)
O4 −0.0391 (4) −0.02611 (13) 0.5606 (2) 0.0358 (7)
N3 −0.1580 (3) 0.14947 (12) 0.7148 (2) 0.0186 (6)
N4 0.2973 (4) −0.05367 (13) 0.6492 (3) 0.0258 (8)
C13 0.0169 (4) 0.11065 (15) 0.7583 (3) 0.0188 (7)
C14 0.0152 (4) 0.04326 (15) 0.8474 (3) 0.0180 (7)
C15 −0.0313 (4) 0.05018 (16) 0.9770 (3) 0.0209 (8)
C16 −0.0171 (5) −0.01003 (17) 1.0661 (3) 0.0224 (8)
C17 0.0435 (4) −0.07820 (16) 1.0259 (3) 0.0209 (8)
C18 0.0923 (4) −0.08572 (14) 0.8968 (3) 0.0206 (7)
C19 0.0795 (4) −0.02558 (15) 0.8073 (3) 0.0189 (7)
C20 0.1098 (5) −0.03514 (15) 0.6626 (3) 0.0235 (8)
C21 −0.1553 (5) 0.22148 (16) 0.6495 (3) 0.0244 (8)
C22 −0.3615 (4) 0.12250 (17) 0.7172 (3) 0.0243 (8)
C23 0.3187 (7) −0.0733 (2) 0.5096 (4) 0.0426 (13)
C24 0.4731 (5) −0.06937 (18) 0.7671 (3) 0.0292 (9)
H3 0.41290 0.10210 −0.01430 0.0230*
H4 0.42730 −0.00230 0.12440 0.0280*
H5 0.64820 −0.00600 0.34780 0.0250*
H6 0.86440 0.09290 0.43050 0.0240*
H9A 0.56090 0.32440 −0.14820 0.0370*
H9B 0.40060 0.36620 −0.08570 0.0370*
H9C 0.32570 0.30750 −0.20520 0.0370*
H10A 0.29320 0.21810 0.11010 0.0350*
H10B 0.15540 0.23350 −0.04200 0.0350*
H10C 0.22350 0.29890 0.06420 0.0350*
H11A 1.13770 0.11860 0.28320 0.0390*
H11B 1.22450 0.12150 0.44730 0.0390*
H11C 1.34530 0.15940 0.34950 0.0390*
H12A 1.13530 0.32080 0.43170 0.0470*
H12B 1.32500 0.28980 0.38510 0.0470*
H12C 1.28750 0.26590 0.52980 0.0470*
H15 −0.07230 0.09570 1.00410 0.0250*
H16 −0.04820 −0.00480 1.15250 0.0270*
H17 0.05160 −0.11880 1.08500 0.0250*
H18 0.13380 −0.13130 0.87050 0.0250*
H21A −0.01970 0.23140 0.63960 0.0370*
H21B −0.19320 0.25870 0.70760 0.0370*
H21C −0.25120 0.22170 0.55830 0.0370*
H22A −0.34750 0.07910 0.77490 0.0360*
H22B −0.43820 0.11070 0.62300 0.0360*
H22C −0.43260 0.16000 0.75520 0.0360*
H23A 0.22120 −0.04580 0.43950 0.0640*
H23B 0.29370 −0.12510 0.49400 0.0640*
H23C 0.45540 −0.06180 0.50360 0.0640*
H24A 0.47420 −0.12090 0.79030 0.0440*
H24B 0.46360 −0.04050 0.84720 0.0440*
H24C 0.59760 −0.05710 0.74170 0.0440*