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. 2022 Mar 22;7(Pt 3):x220295. doi: 10.1107/S2414314622002954
x y z Uiso*/Ueq
Ni1 0.67356 (2) 0.70309 (2) 0.69948 (3) 0.03734 (10)
Cl1 0.68036 (2) 0.49257 (2) 1.08616 (9) 0.06233 (19)
O1 0.71130 (5) 0.74129 (5) 0.5847 (2) 0.0506 (4)
O2 0.63727 (4) 0.66083 (5) 0.7940 (2) 0.0468 (4)
O3 0.86943 (7) 0.82096 (6) 0.1939 (3) 0.0818 (6)
N1 0.75900 (5) 0.68423 (6) 0.6093 (2) 0.0444 (4)
N2 0.72374 (5) 0.66565 (5) 0.6917 (2) 0.0407 (4)
N3 0.62734 (6) 0.74687 (6) 0.6931 (2) 0.0469 (4)
N4 0.59505 (7) 0.80650 (7) 0.6168 (3) 0.0573 (5)
H4 0.5865 (10) 0.8318 (11) 0.566 (4) 0.100 (11)*
C1 0.69302 (6) 0.60618 (6) 0.8443 (3) 0.0395 (5)
C2 0.70039 (8) 0.56518 (7) 0.9178 (3) 0.0468 (5)
H2 0.728018 0.553255 0.912614 0.056*
C3 0.66852 (8) 0.54265 (7) 0.9955 (3) 0.0471 (5)
C4 0.62689 (8) 0.55887 (7) 1.0092 (3) 0.0494 (5)
H4A 0.605335 0.543496 1.064097 0.059*
C5 0.61852 (7) 0.59863 (7) 0.9385 (3) 0.0478 (5)
H5 0.590670 0.609875 0.946780 0.057*
C6 0.64995 (7) 0.62290 (7) 0.8548 (3) 0.0406 (5)
C7 0.72926 (7) 0.62824 (7) 0.7636 (3) 0.0418 (5)
C8 0.77365 (8) 0.60794 (9) 0.7632 (4) 0.0637 (7)
H8A 0.772858 0.581362 0.701572 0.095*
H8B 0.782430 0.602062 0.875021 0.095*
H8C 0.793945 0.627451 0.712772 0.095*
C9 0.74864 (7) 0.72329 (7) 0.5599 (3) 0.0430 (5)
C10 0.78074 (7) 0.74904 (7) 0.4658 (3) 0.0436 (5)
C11 0.82214 (7) 0.73375 (8) 0.4304 (3) 0.0512 (6)
H11 0.830661 0.706668 0.468830 0.061*
C12 0.85065 (8) 0.75850 (8) 0.3386 (3) 0.0585 (6)
H12 0.878025 0.747719 0.313970 0.070*
C13 0.83883 (8) 0.79913 (8) 0.2832 (3) 0.0544 (6)
C14 0.79796 (8) 0.81495 (8) 0.3173 (3) 0.0531 (6)
H14 0.789633 0.842107 0.279077 0.064*
C15 0.76968 (7) 0.79008 (7) 0.4085 (3) 0.0487 (5)
H15 0.742350 0.801047 0.432655 0.058*
C16 0.85944 (10) 0.86421 (8) 0.1450 (4) 0.0709 (8)
H16A 0.836204 0.863811 0.066026 0.106*
H16B 0.884538 0.877267 0.095671 0.106*
H16C 0.850860 0.880669 0.240361 0.106*
C17 0.58978 (7) 0.75137 (7) 0.7827 (3) 0.0517 (6)
H17 0.579704 0.732134 0.862486 0.062*
C18 0.56989 (8) 0.78836 (8) 0.7357 (4) 0.0587 (6)
H18 0.543965 0.799272 0.776902 0.070*
C19 0.62897 (8) 0.78101 (7) 0.5950 (3) 0.0527 (6)
H19 0.651171 0.786450 0.519968 0.063*