Skip to main content
. 2010 Oct 13;66(Pt 11):o2806–o2807. doi: 10.1107/S1600536810040079
x y z Uiso*/Ueq
O1 0.65593 (7) 0.65589 (10) 0.67564 (5) 0.0159 (2)
H1o 0.6569 (15) 0.594 (2) 0.6365 (9) 0.048 (6)*
O2 0.73862 (7) 1.02234 (10) 0.49100 (5) 0.0170 (2)
O3 0.73479 (7) 0.82683 (11) 0.37346 (5) 0.0170 (2)
H3o 0.7407 (13) 0.8846 (19) 0.4154 (8) 0.036 (5)*
O4 0.63116 (6) 0.46796 (10) 0.55110 (5) 0.0163 (2)
O5 0.99653 (7) 0.53999 (12) 0.35663 (6) 0.0237 (2)
O6 1.13360 (7) 0.63202 (12) 0.40630 (6) 0.0259 (2)
N1 1.04746 (8) 0.61823 (13) 0.40582 (7) 0.0176 (2)
C1 0.71426 (9) 0.83167 (14) 0.58531 (7) 0.0129 (2)
C2 0.67059 (9) 0.79995 (14) 0.65085 (7) 0.0134 (2)
C3 0.63844 (9) 0.92120 (14) 0.70461 (7) 0.0153 (3)
H3A 0.6898 0.9405 0.7493 0.018*
H3B 0.5829 0.8817 0.7279 0.018*
C4 0.61160 (9) 1.07463 (14) 0.66175 (7) 0.0149 (3)
C5 0.69030 (10) 1.11682 (15) 0.61177 (8) 0.0184 (3)
H5A 0.6701 1.2088 0.5788 0.022*
H5B 0.7480 1.1453 0.6486 0.022*
C6 0.71497 (9) 0.98965 (15) 0.55741 (8) 0.0145 (3)
C7 0.51615 (10) 1.05773 (17) 0.60799 (8) 0.0217 (3)
H7A 0.4669 1.0306 0.6409 0.032*
H7B 0.5209 0.9761 0.5684 0.032*
H7C 0.4997 1.1557 0.5803 0.032*
C8 0.60339 (10) 1.20199 (15) 0.72332 (8) 0.0187 (3)
H8A 0.5531 1.1754 0.7554 0.028*
H8B 0.5880 1.3002 0.6955 0.028*
H8C 0.6638 1.2121 0.7585 0.028*
C9 0.76179 (8) 0.70610 (14) 0.54208 (7) 0.0124 (2)
H9 0.7692 0.6185 0.5812 0.015*
C10 0.70261 (9) 0.63781 (14) 0.46833 (7) 0.0129 (2)
C11 0.69851 (9) 0.69205 (14) 0.39210 (8) 0.0139 (3)
C12 0.65447 (9) 0.60340 (15) 0.31987 (8) 0.0162 (3)
H12A 0.6947 0.6153 0.2767 0.019*
H12B 0.5916 0.6487 0.3006 0.019*
C13 0.64204 (9) 0.43071 (15) 0.33584 (8) 0.0162 (3)
C14 0.59406 (10) 0.41744 (16) 0.41182 (8) 0.0189 (3)
H14A 0.5281 0.4556 0.3999 0.023*
H14B 0.5913 0.3070 0.4268 0.023*
C15 0.64394 (9) 0.50637 (14) 0.48217 (7) 0.0140 (2)
C16 0.57961 (10) 0.35702 (17) 0.26472 (8) 0.0228 (3)
H16A 0.5718 0.2467 0.2752 0.034*
H16B 0.6097 0.3698 0.2161 0.034*
H16C 0.5174 0.4074 0.2573 0.034*
C17 0.73790 (10) 0.34775 (15) 0.34742 (8) 0.0201 (3)
H17A 0.7282 0.2378 0.3577 0.030*
H17B 0.7786 0.3932 0.3931 0.030*
H17C 0.7683 0.3592 0.2989 0.030*
C18 0.86411 (8) 0.74648 (14) 0.53038 (7) 0.0130 (2)
C19 0.91956 (9) 0.84390 (15) 0.58406 (8) 0.0156 (3)
H19 0.8912 0.8949 0.6248 0.019*
C20 1.01514 (9) 0.86788 (15) 0.57927 (8) 0.0175 (3)
H20 1.0509 0.9350 0.6165 0.021*
C21 1.05918 (9) 0.79508 (15) 0.52075 (8) 0.0171 (3)
H21 1.1245 0.8105 0.5170 0.021*
C22 1.00352 (9) 0.69910 (15) 0.46819 (7) 0.0150 (3)
C23 0.90774 (9) 0.67322 (14) 0.47154 (7) 0.0144 (3)
H23 0.8724 0.6062 0.4340 0.017*