x | y | z | Uiso*/Ueq | ||
O1 | 0.51156 (8) | 0.90454 (8) | 0.65034 (6) | 0.01864 (19) | |
O2 | 0.81349 (8) | 0.63845 (8) | 0.39970 (6) | 0.0221 (2) | |
O3 | 0.61653 (8) | 0.68768 (8) | 0.42496 (6) | 0.0209 (2) | |
O4 | 0.22108 (8) | 0.77982 (8) | 0.47938 (6) | 0.01792 (19) | |
O5 | 0.18927 (8) | 0.77876 (8) | 0.62760 (6) | 0.0217 (2) | |
N1 | 0.71846 (9) | 0.83091 (9) | 0.64775 (7) | 0.0145 (2) | |
N2 | 0.58627 (9) | 0.71116 (9) | 0.70549 (7) | 0.0143 (2) | |
N3 | 0.79091 (9) | 0.81926 (9) | 0.46197 (7) | 0.0149 (2) | |
N4 | 0.33456 (9) | 0.64839 (9) | 0.58183 (7) | 0.0158 (2) | |
C1 | 0.59511 (11) | 0.82469 (11) | 0.66601 (8) | 0.0143 (2) | |
C2 | 0.78498 (11) | 0.72200 (10) | 0.67384 (8) | 0.0142 (2) | |
C3 | 0.70112 (11) | 0.64616 (11) | 0.71027 (7) | 0.0137 (2) | |
C4 | 0.73829 (11) | 0.52998 (11) | 0.74338 (8) | 0.0157 (2) | |
H4 | 0.6828 | 0.4800 | 0.7679 | 0.019* | |
C5 | 0.86290 (11) | 0.49150 (11) | 0.73819 (8) | 0.0174 (3) | |
H5 | 0.8907 | 0.4137 | 0.7591 | 0.021* | |
C6 | 0.94645 (11) | 0.56687 (11) | 0.70237 (8) | 0.0176 (3) | |
H6 | 1.0288 | 0.5384 | 0.7000 | 0.021* | |
C7 | 0.90915 (11) | 0.68422 (11) | 0.66999 (8) | 0.0162 (2) | |
H7 | 0.9653 | 0.7350 | 0.6468 | 0.019* | |
C8 | 0.76194 (11) | 0.93510 (10) | 0.60123 (8) | 0.0159 (2) | |
H8A | 0.8558 | 0.9432 | 0.6227 | 0.019* | |
H8B | 0.7223 | 1.0086 | 0.6190 | 0.019* | |
C9 | 0.72673 (11) | 0.92265 (11) | 0.49385 (8) | 0.0162 (2) | |
H9A | 0.6330 | 0.9132 | 0.4724 | 0.019* | |
H9B | 0.7516 | 0.9966 | 0.4659 | 0.019* | |
C10 | 0.72954 (11) | 0.71504 (11) | 0.42958 (8) | 0.0160 (2) | |
C11 | 0.94356 (12) | 0.69048 (12) | 0.42409 (9) | 0.0210 (3) | |
H11A | 0.9846 | 0.6861 | 0.3709 | 0.025* | |
H11B | 0.9977 | 0.6475 | 0.4771 | 0.025* | |
C12 | 0.92429 (11) | 0.82316 (11) | 0.45003 (8) | 0.0170 (3) | |
H12A | 0.9852 | 0.8466 | 0.5080 | 0.020* | |
H12B | 0.9329 | 0.8785 | 0.3998 | 0.020* | |
C13 | 0.47432 (11) | 0.67173 (11) | 0.74094 (8) | 0.0156 (2) | |
H13A | 0.4262 | 0.7430 | 0.7533 | 0.019* | |
H13B | 0.5050 | 0.6290 | 0.8002 | 0.019* | |
C14 | 0.38313 (11) | 0.58849 (11) | 0.67225 (8) | 0.0169 (2) | |
H14A | 0.4293 | 0.5147 | 0.6628 | 0.020* | |
H14B | 0.3102 | 0.5655 | 0.6989 | 0.020* | |
C15 | 0.24555 (11) | 0.73773 (11) | 0.57032 (8) | 0.0159 (2) | |
C16 | 0.31809 (12) | 0.72690 (11) | 0.43458 (9) | 0.0198 (3) | |
H16A | 0.3889 | 0.7837 | 0.4355 | 0.024* | |
H16B | 0.2794 | 0.7048 | 0.3697 | 0.024* | |
C17 | 0.36658 (12) | 0.61423 (11) | 0.49327 (8) | 0.0197 (3) | |
H17A | 0.3204 | 0.5413 | 0.4665 | 0.024* | |
H17B | 0.4596 | 0.6023 | 0.5006 | 0.024* |