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. 2015 Aug 6;71(Pt 9):o635. doi: 10.1107/S2056989015013730
x y z Uiso*/Ueq
N1 0.33343 (18) 0.36839 (7) 0.53687 (9) 0.0409 (3)
C11 0.2512 (2) 0.49937 (9) 0.03244 (11) 0.0373 (3)
C16 0.1639 (2) 0.65848 (9) −0.23484 (11) 0.0433 (4)
C7 0.2711 (2) 0.47837 (9) 0.23353 (10) 0.0380 (3)
C14 0.2517 (2) 0.52940 (9) −0.15944 (11) 0.0441 (4)
H14 0.2917 0.4765 −0.1669 0.053*
C9 0.3390 (2) 0.36047 (9) 0.34742 (11) 0.0412 (4)
H9 0.3709 0.3059 0.3557 0.049*
C4 0.3103 (2) 0.40518 (9) 0.43461 (10) 0.0379 (3)
C13 0.2195 (2) 0.55534 (8) −0.06072 (11) 0.0370 (3)
C5 0.2614 (2) 0.48643 (9) 0.42196 (11) 0.0458 (4)
H5 0.2416 0.5167 0.4802 0.055*
C10 0.2475 (2) 0.52285 (9) 0.13288 (11) 0.0404 (4)
H10 0.2257 0.5780 0.1395 0.048*
C6 0.2421 (2) 0.52205 (9) 0.32260 (11) 0.0438 (4)
H6 0.2091 0.5765 0.3147 0.053*
C8 0.3203 (2) 0.39658 (9) 0.24824 (11) 0.0421 (4)
H8 0.3408 0.3661 0.1904 0.050*
N4 0.1372 (2) 0.71310 (10) −0.32681 (11) 0.0563 (4)
C18 0.1554 (2) 0.63447 (9) −0.05281 (11) 0.0441 (4)
H18 0.1308 0.6527 0.0120 0.053*
C15 0.2251 (2) 0.58088 (10) −0.24634 (11) 0.0481 (4)
H15 0.2484 0.5632 −0.3117 0.058*
O2 0.0835 (2) 0.78255 (8) −0.31500 (10) 0.0736 (4)
O1 0.1702 (2) 0.68742 (9) −0.41145 (10) 0.0818 (5)
C17 0.1280 (2) 0.68607 (9) −0.13928 (12) 0.0461 (4)
H17 0.0859 0.7388 −0.1331 0.055*
N3 0.3111 (3) 0.35246 (9) −0.02129 (11) 0.0666 (5)
C12 0.2850 (2) 0.41644 (10) 0.00623 (11) 0.0448 (4)
N2 0.4589 (2) 0.29296 (8) 0.67745 (10) 0.0579 (4)
C1 0.4684 (2) 0.31340 (9) 0.57988 (12) 0.0496 (4)
H1 0.5579 0.2926 0.5436 0.059*
C3 0.2306 (3) 0.38325 (10) 0.61467 (12) 0.0562 (5)
H3 0.1281 0.4184 0.6103 0.067*
C2 0.3083 (3) 0.33654 (10) 0.69857 (12) 0.0603 (5)
H2 0.2653 0.3342 0.7625 0.072*