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. 2013 Aug 3;69(Pt 9):o1380–o1381. doi: 10.1107/S1600536813021181
x y z Uiso*/Ueq
C1 0.2531 (2) 1.32368 (19) 0.26884 (15) 0.0403 (4)
H1 0.1710 1.3834 0.3094 0.048*
C2 0.3654 (2) 1.3910 (2) 0.20151 (16) 0.0453 (4)
H2 0.3626 1.4961 0.1983 0.054*
C3 0.48192 (19) 1.2977 (2) 0.13907 (15) 0.0427 (4)
C4 0.49206 (19) 1.1433 (2) 0.14415 (16) 0.0431 (4)
H4 0.5719 1.0831 0.1008 0.052*
C5 0.38164 (18) 1.07952 (19) 0.21467 (15) 0.0373 (4)
H5 0.3883 0.9756 0.2206 0.045*
C6 0.26034 (17) 1.16853 (17) 0.27713 (13) 0.0317 (3)
C7 0.13772 (17) 1.09405 (17) 0.35343 (14) 0.0326 (3)
H7 0.0602 1.1724 0.3894 0.039*
C8 0.04677 (17) 0.96034 (18) 0.27041 (13) 0.0330 (3)
C9 −0.07332 (18) 0.9969 (2) 0.18054 (15) 0.0386 (4)
C10 −0.1554 (2) 0.8623 (2) 0.09238 (16) 0.0456 (4)
H10A −0.1777 0.8934 0.0138 0.055*
H10B −0.2583 0.8373 0.1271 0.055*
C11 −0.0557 (2) 0.7178 (2) 0.06734 (15) 0.0446 (4)
H11A 0.0400 0.7369 0.0210 0.054*
H11B −0.1188 0.6322 0.0170 0.054*
C12 −0.0052 (2) 0.6741 (2) 0.18949 (15) 0.0434 (4)
H12A −0.0992 0.6358 0.2284 0.052*
H12B 0.0720 0.5918 0.1732 0.052*
C13 0.06922 (18) 0.81242 (18) 0.27499 (14) 0.0349 (3)
C14 0.23414 (18) 0.87924 (18) 0.45824 (14) 0.0337 (3)
C15 0.21916 (18) 1.03614 (17) 0.45763 (13) 0.0336 (3)
C16 0.3124 (3) 0.6535 (2) 0.5443 (2) 0.0685 (6)
H16A 0.2041 0.6094 0.5407 0.103*
H16B 0.3655 0.6397 0.6195 0.103*
H16C 0.3714 0.6023 0.4733 0.103*
N1 0.30687 (19) 0.81832 (17) 0.54344 (13) 0.0445 (4)
N2 0.28580 (17) 1.14864 (16) 0.55398 (12) 0.0405 (3)
N3 0.5987 (2) 1.3655 (3) 0.06260 (18) 0.0627 (5)
O1 0.16935 (14) 0.76920 (13) 0.36371 (10) 0.0414 (3)
O2 −0.10506 (16) 1.13167 (16) 0.18180 (13) 0.0544 (4)
O3 0.36526 (17) 1.11096 (15) 0.64145 (11) 0.0535 (3)
O4 0.26560 (19) 1.28774 (14) 0.55197 (12) 0.0579 (4)
O5 0.6313 (2) 1.5047 (2) 0.09323 (18) 0.0934 (6)
O6 0.6534 (2) 1.2794 (2) −0.02896 (18) 0.0874 (6)
H1A 0.349 (4) 0.891 (3) 0.607 (2) 0.105*