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. 2018 Feb 20;74(Pt 3):367–370. doi: 10.1107/S2056989018002621
x y z Uiso*/Ueq
C1 0.0390 (2) 0.7259 (2) 0.4925 (3) 0.0581 (10)
H1 −0.014021 0.716332 0.501878 0.070*
C2 0.0662 (2) 0.7372 (2) 0.3863 (3) 0.0597 (10)
H2 0.032912 0.733641 0.324888 0.072*
C3 0.1444 (2) 0.7541 (2) 0.3716 (3) 0.0558 (9)
H3 0.164641 0.761427 0.299904 0.067*
C4 0.19186 (19) 0.76002 (19) 0.4641 (3) 0.0451 (8)
C5 0.1594 (2) 0.7450 (2) 0.5683 (3) 0.0524 (9)
H5 0.191757 0.746889 0.630959 0.063*
C6 0.27446 (19) 0.78337 (18) 0.4538 (3) 0.0433 (8)
C7 0.3820 (2) 0.81015 (19) 0.3807 (3) 0.0452 (8)
C8 0.5188 (2) 0.8326 (2) 0.3714 (3) 0.0530 (9)
H8 0.557656 0.853590 0.319160 0.064*
C9 0.5062 (2) 0.8898 (2) 0.4669 (4) 0.0575 (10)
H9A 0.555879 0.903724 0.500282 0.069*
H9B 0.481787 0.936913 0.438785 0.069*
C10 0.4545 (2) 0.85180 (19) 0.5536 (3) 0.0484 (8)
C11 0.4295 (2) 0.9041 (2) 0.6485 (4) 0.0620 (11)
H11A 0.401451 0.947929 0.618728 0.093*
H11B 0.396382 0.875548 0.698823 0.093*
H11C 0.474656 0.922184 0.688324 0.093*
C12 0.53691 (18) 0.74016 (18) 0.5322 (3) 0.0432 (8)
C13 0.54834 (18) 0.75667 (19) 0.4207 (3) 0.0460 (8)
C14 0.5883 (2) 0.7029 (2) 0.3536 (3) 0.0557 (10)
H14 0.596039 0.713003 0.277630 0.067*
C15 0.6162 (2) 0.6352 (2) 0.4004 (4) 0.0631 (11)
H15 0.642215 0.599352 0.355389 0.076*
C16 0.6062 (2) 0.6195 (2) 0.5133 (3) 0.0576 (10)
H16 0.625672 0.573495 0.543568 0.069*
C17 0.56737 (19) 0.6719 (2) 0.5813 (3) 0.0471 (8)
C18 0.5850 (3) 0.5943 (3) 0.7453 (4) 0.0716 (12)
H18A 0.641332 0.593704 0.738080 0.086*
H18B 0.564269 0.547848 0.709738 0.086*
C19 0.5622 (3) 0.5965 (3) 0.8665 (4) 0.1006 (17)
H19A 0.582492 0.551306 0.903941 0.151*
H19B 0.583133 0.642681 0.900739 0.151*
H19C 0.506407 0.597026 0.872521 0.151*
N1 0.08383 (17) 0.72774 (19) 0.5838 (3) 0.0572 (8)
N2 0.31602 (16) 0.80437 (15) 0.5418 (2) 0.0458 (7)
N3 0.38723 (15) 0.82148 (16) 0.4920 (2) 0.0442 (7)
N4 0.31108 (15) 0.78598 (17) 0.3519 (2) 0.0467 (7)
N5 0.44380 (16) 0.82375 (18) 0.3130 (2) 0.0542 (8)
H5A 0.439554 0.826988 0.241203 0.065*
O1 0.49588 (12) 0.78802 (13) 0.60565 (18) 0.0468 (6)
O2 0.55363 (14) 0.66252 (14) 0.6933 (2) 0.0567 (7)