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. 2010 Nov 27;66(Pt 12):o3336. doi: 10.1107/S1600536810049111
x y z Uiso*/Ueq
N1 0.1744 (2) 0.09152 (8) 0.62991 (8) 0.0427 (5)
C1 0.6103 (3) 0.28645 (12) 0.57631 (12) 0.0604 (7)
H1A 0.6752 0.3217 0.5569 0.073*
N2 −0.1771 (2) 0.03706 (8) 0.61285 (8) 0.0432 (5)
C2 0.5050 (3) 0.24229 (12) 0.54133 (10) 0.0533 (6)
H2A 0.4989 0.2477 0.4981 0.064*
C3 0.4087 (3) 0.19002 (11) 0.57034 (10) 0.0449 (6)
H3A 0.3382 0.1604 0.5463 0.054*
C4 0.4150 (3) 0.18090 (10) 0.63433 (10) 0.0413 (5)
C5 0.5204 (3) 0.22622 (11) 0.66895 (11) 0.0542 (6)
H5A 0.5252 0.2218 0.7123 0.065*
C6 0.6185 (3) 0.27799 (12) 0.63953 (13) 0.0634 (7)
H6A 0.6908 0.3073 0.6632 0.076*
C7 0.3183 (3) 0.12199 (11) 0.66679 (10) 0.0504 (6)
H7A 0.4034 0.0855 0.6769 0.061*
H7B 0.2696 0.1393 0.7059 0.061*
C8 0.0184 (3) 0.13693 (10) 0.62714 (10) 0.0474 (6)
H8A 0.0520 0.1819 0.6098 0.057*
H8B −0.0268 0.1446 0.6691 0.057*
C9 −0.1255 (3) 0.10464 (10) 0.58725 (10) 0.0480 (6)
H9A −0.2282 0.1354 0.5860 0.058*
H9B −0.0824 0.0987 0.5448 0.058*
C10 −0.0218 (3) −0.00859 (10) 0.61446 (10) 0.0483 (6)
H10A 0.0230 −0.0154 0.5723 0.058*
H10B −0.0551 −0.0539 0.6313 0.058*
C11 0.1210 (3) 0.02366 (10) 0.65474 (10) 0.0478 (6)
H11A 0.0768 0.0293 0.6971 0.057*
H11B 0.2235 −0.0072 0.6562 0.057*
C12 −0.3259 (3) 0.00581 (11) 0.57907 (10) 0.0497 (6)
H12A −0.2825 −0.0132 0.5399 0.060*
H12B −0.4116 0.0421 0.5692 0.060*
C13 −0.4189 (3) −0.05156 (10) 0.61511 (9) 0.0396 (5)
C14 −0.5306 (3) −0.09799 (11) 0.58415 (10) 0.0494 (6)
H14A −0.5413 −0.0954 0.5408 0.059*
C15 −0.6260 (3) −0.14791 (12) 0.61664 (12) 0.0569 (6)
H15A −0.7012 −0.1782 0.5952 0.068*
C16 −0.6102 (3) −0.15299 (11) 0.68032 (12) 0.0555 (6)
H16A −0.6745 −0.1866 0.7022 0.067*
C17 −0.4989 (3) −0.10828 (11) 0.71169 (10) 0.0505 (6)
H17A −0.4870 −0.1119 0.7549 0.061*
C18 −0.4041 (3) −0.05765 (11) 0.67923 (10) 0.0440 (6)
H18A −0.3295 −0.0274 0.7010 0.053*