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. 2017 Sep 29;73(Pt 10):1546–1550. doi: 10.1107/S2056989017013536
x y z Uiso*/Ueq
Cl1 0.42856 (5) 0.16233 (3) −0.07860 (2) 0.01668 (7)
Cl2 1.13911 (5) 0.28348 (3) 0.52483 (2) 0.01730 (7)
O1 0.03685 (16) −0.10701 (11) −0.14946 (5) 0.02014 (18)
O2 0.33010 (15) 0.24516 (10) 0.08473 (5) 0.01729 (17)
O3 1.55337 (16) 0.23416 (11) 0.62981 (5) 0.01865 (17)
O4 1.14201 (15) 0.00027 (10) 0.38854 (5) 0.01586 (16)
O5 0.18017 (16) 0.33437 (10) 0.25526 (5) 0.01818 (17)
H5 0.118 (3) 0.263 (2) 0.2115 (10) 0.027*
O6 0.74923 (17) 0.40347 (11) 0.05992 (5) 0.02044 (18)
H6 0.617 (3) 0.350 (2) 0.0681 (11) 0.031*
N1 0.76255 (18) 0.16991 (12) 0.35832 (6) 0.01695 (19)
H1 0.896 (3) 0.128 (2) 0.3779 (10) 0.025*
N2 1.04584 (18) 0.71260 (12) 0.25721 (6) 0.01696 (19)
H2 1.114 (3) 0.777 (2) 0.2998 (10) 0.025*
C1 0.02618 (19) −0.05358 (13) −0.08002 (6) 0.01355 (19)
C2 0.19204 (19) 0.07509 (13) −0.03554 (6) 0.01332 (19)
C3 0.18242 (19) 0.13365 (13) 0.04220 (6) 0.01289 (19)
C4 1.52060 (19) 0.12916 (13) 0.56903 (6) 0.01293 (19)
C5 1.33437 (19) 0.12624 (13) 0.51055 (6) 0.01346 (19)
C6 1.30221 (19) 0.00728 (13) 0.44252 (6) 0.01271 (19)
C7 0.6571 (2) 0.30150 (14) 0.39505 (7) 0.0178 (2)
H7 0.719110 0.355184 0.445342 0.021*
C8 0.4617 (2) 0.35945 (14) 0.36116 (7) 0.0169 (2)
H8 0.390102 0.453256 0.387366 0.020*
C9 0.3693 (2) 0.27801 (13) 0.28719 (6) 0.0141 (2)
C10 0.4863 (2) 0.14337 (14) 0.24949 (6) 0.0169 (2)
H10 0.430463 0.088006 0.198898 0.020*
C11 0.6819 (2) 0.09297 (15) 0.28659 (7) 0.0180 (2)
H11 0.761693 0.002289 0.261273 0.022*
C12 0.8247 (2) 0.62477 (14) 0.25631 (6) 0.0169 (2)
H12 0.743357 0.635815 0.301370 0.020*
C13 0.7170 (2) 0.51997 (14) 0.19096 (6) 0.0152 (2)
H13 0.560916 0.459117 0.190415 0.018*
C14 0.8392 (2) 0.50334 (13) 0.12492 (6) 0.0145 (2)
C15 1.0695 (2) 0.59750 (15) 0.12741 (7) 0.0178 (2)
H15 1.155223 0.590054 0.083294 0.021*
C16 1.1663 (2) 0.69955 (15) 0.19462 (7) 0.0181 (2)
H16 1.321913 0.762460 0.197088 0.022*