Skip to main content
. 2018 Aug 21;74(Pt 9):1302–1308. doi: 10.1107/S2056989018011131
x y z Uiso*/Ueq
N1 0.30258 (17) 0.43671 (10) 0.60520 (10) 0.0541 (4)
O1 1.00894 (17) 0.82396 (12) 0.67889 (10) 0.0940 (6)
C1 0.92274 (19) 0.86663 (11) 0.48174 (11) 0.0484 (4)
C2 1.0196 (2) 0.79632 (13) 0.46961 (14) 0.0628 (5)
H2A 1.0445 0.7544 0.5119 0.075*
C3 1.0762 (2) 0.78928 (16) 0.39769 (16) 0.0734 (6)
H3A 1.1383 0.7423 0.3909 0.088*
C4 1.0418 (3) 0.85254 (18) 0.33286 (14) 0.0760 (7)
H4A 1.0812 0.8469 0.2836 0.091*
C5 0.9521 (2) 0.92119 (15) 0.34183 (12) 0.0661 (6)
H5A 0.9315 0.9629 0.2989 0.079*
C6 0.8883 (2) 0.93085 (12) 0.41595 (11) 0.0509 (4)
C7 0.7968 (2) 1.00127 (12) 0.42694 (11) 0.0527 (5)
H7A 0.7763 1.0435 0.3845 0.063*
C8 0.73470 (19) 1.01073 (11) 0.49924 (11) 0.0476 (4)
C9 0.6398 (2) 1.08243 (12) 0.51020 (13) 0.0578 (5)
H9A 0.6192 1.1250 0.4680 0.069*
C10 0.5788 (2) 1.09027 (14) 0.58016 (14) 0.0659 (5)
H10A 0.5173 1.1379 0.5859 0.079*
C11 0.6082 (2) 1.02632 (15) 0.64463 (13) 0.0664 (5)
H11A 0.5654 1.0320 0.6927 0.080*
C12 0.6979 (2) 0.95678 (14) 0.63762 (12) 0.0578 (5)
H12A 0.7153 0.9151 0.6808 0.069*
C13 0.76632 (18) 0.94624 (11) 0.56498 (10) 0.0464 (4)
C14 0.86110 (18) 0.87608 (11) 0.55531 (10) 0.0474 (4)
C15 0.9024 (2) 0.81029 (13) 0.62560 (12) 0.0572 (5)
C16 0.8125 (2) 0.73143 (12) 0.62919 (12) 0.0567 (5)
H16A 0.8441 0.6888 0.6699 0.068*
C17 0.6880 (2) 0.71662 (11) 0.57782 (11) 0.0511 (4)
H17A 0.6618 0.7581 0.5352 0.061*
C18 0.5880 (2) 0.64229 (11) 0.58115 (11) 0.0484 (4)
C19 0.6285 (2) 0.56538 (11) 0.62652 (11) 0.0494 (4)
H19A 0.7240 0.5585 0.6536 0.059*
C20 0.52804 (19) 0.49902 (11) 0.63166 (10) 0.0458 (4)
C21 0.5346 (2) 0.41144 (11) 0.67115 (11) 0.0496 (4)
C22 0.6445 (2) 0.36261 (13) 0.71850 (12) 0.0609 (5)
H22A 0.7386 0.3852 0.7306 0.073*
C23 0.6120 (3) 0.28028 (14) 0.74725 (14) 0.0720 (6)
H23A 0.6849 0.2471 0.7796 0.086*
C24 0.4721 (3) 0.24555 (14) 0.72885 (14) 0.0764 (7)
H24A 0.4536 0.1894 0.7491 0.092*
C25 0.3595 (3) 0.29223 (13) 0.68122 (13) 0.0644 (5)
H25A 0.2661 0.2686 0.6686 0.077*
C26 0.3929 (2) 0.37631 (11) 0.65312 (11) 0.0504 (4)
C27 0.38240 (19) 0.51092 (11) 0.59169 (11) 0.0481 (4)
C28 0.3391 (2) 0.58737 (12) 0.54582 (12) 0.0565 (5)
H28A 0.2431 0.5951 0.5199 0.068*
C29 0.4432 (2) 0.65129 (12) 0.54014 (11) 0.0555 (5)
H29A 0.4170 0.7020 0.5082 0.067*
C30 0.1472 (2) 0.42573 (14) 0.57684 (13) 0.0654 (5)
H30A 0.1256 0.3628 0.5693 0.079*
H30B 0.1209 0.4546 0.5227 0.079*
C31 0.0561 (3) 0.4638 (2) 0.63703 (16) 0.0956 (8)
H31A −0.0451 0.4547 0.6153 0.143*
H31B 0.0799 0.4345 0.6905 0.143*
H31C 0.0752 0.5264 0.6439 0.143*