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. 2010 Dec 18;67(Pt 1):o192. doi: 10.1107/S1600536810051536
x y z Uiso*/Ueq
Cl1 0.62065 (7) 0.20187 (5) 0.20512 (3) 0.0746 (2)
O2 0.41212 (13) 0.41383 (9) 0.58832 (8) 0.0428 (3)
O3 0.59219 (14) 0.46948 (9) 0.67954 (8) 0.0462 (3)
O4 0.72015 (17) −0.03918 (9) 0.68325 (9) 0.0606 (4)
H401 0.7879 −0.0416 0.7202 0.091*
O1 0.64832 (15) 0.37003 (10) 0.44750 (9) 0.0502 (3)
H101 0.6332 0.4338 0.4338 0.075*
N1 0.34605 (15) 0.35386 (10) 0.41842 (9) 0.0364 (3)
H1A 0.3652 0.4102 0.3852 0.044*
H1B 0.3687 0.3748 0.4723 0.044*
C17 0.7690 (2) 0.15336 (13) 0.68657 (10) 0.0398 (4)
H17 0.8653 0.1407 0.7036 0.048*
C13 0.57588 (18) 0.28014 (12) 0.64942 (10) 0.0352 (4)
C6 0.68166 (18) 0.20139 (13) 0.37627 (11) 0.0387 (4)
C7 0.58728 (18) 0.30067 (13) 0.38234 (11) 0.0377 (4)
H7 0.5787 0.3401 0.3285 0.045*
C8 0.44059 (18) 0.26082 (12) 0.40065 (11) 0.0379 (4)
H8A 0.3967 0.2201 0.3525 0.045*
H8B 0.4511 0.2122 0.4489 0.045*
C12 0.52260 (19) 0.39509 (12) 0.63789 (10) 0.0364 (4)
C18 0.71869 (19) 0.25922 (13) 0.67590 (10) 0.0373 (4)
H18 0.7817 0.3172 0.6867 0.045*
C16 0.6755 (2) 0.06630 (13) 0.67183 (11) 0.0419 (4)
C1 0.7039 (2) 0.15117 (15) 0.30082 (12) 0.0475 (4)
C5 0.7444 (2) 0.15316 (15) 0.45040 (13) 0.0485 (4)
H5 0.7312 0.1846 0.5021 0.058*
C9 0.18745 (19) 0.33141 (15) 0.40517 (12) 0.0459 (4)
H9 0.1636 0.3057 0.3471 0.055*
C14 0.4843 (2) 0.19169 (14) 0.63267 (12) 0.0451 (4)
H14 0.3886 0.2039 0.6138 0.054*
C15 0.5339 (2) 0.08564 (14) 0.64370 (13) 0.0499 (5)
H15 0.4715 0.0274 0.6321 0.060*
C4 0.8256 (2) 0.05966 (16) 0.44857 (16) 0.0592 (6)
H4 0.8649 0.0280 0.4988 0.071*
C2 0.7882 (2) 0.05865 (17) 0.29803 (16) 0.0620 (6)
H2 0.8036 0.0276 0.2465 0.074*
C3 0.8488 (2) 0.01326 (17) 0.37280 (18) 0.0661 (6)
H3 0.9053 −0.0489 0.3718 0.079*
C10 0.1482 (2) 0.2436 (2) 0.46424 (17) 0.0748 (7)
H10A 0.2010 0.1784 0.4549 0.112*
H10B 0.0476 0.2288 0.4540 0.112*
H10C 0.1709 0.2673 0.5215 0.112*
C11 0.1090 (3) 0.4372 (2) 0.4154 (2) 0.0839 (8)
H11A 0.1381 0.4901 0.3761 0.126*
H11B 0.1313 0.4639 0.4719 0.126*
H11C 0.0079 0.4251 0.4046 0.126*