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. 2020 Oct 30;76(Pt 11):1779–1793. doi: 10.1107/S2056989020014097
U11 U22 U33 U12 U13 U23
N1 0.0481 (7) 0.0554 (8) 0.0341 (6) 0.0041 (6) 0.0078 (5) −0.0034 (6)
C2 0.0574 (9) 0.0535 (9) 0.0410 (8) −0.0073 (8) 0.0034 (7) −0.0110 (7)
C3 0.0444 (8) 0.0490 (9) 0.0395 (7) −0.0089 (7) 0.0027 (6) −0.0033 (7)
N4 0.0394 (6) 0.0450 (7) 0.0321 (6) −0.0041 (5) 0.0041 (5) −0.0029 (5)
C5 0.0409 (8) 0.0510 (9) 0.0372 (7) −0.0061 (7) 0.0039 (6) −0.0064 (6)
C6 0.0412 (8) 0.0611 (10) 0.0377 (7) −0.0022 (7) 0.0038 (6) −0.0026 (7)
C21 0.0424 (8) 0.0419 (8) 0.0383 (7) −0.0049 (6) 0.0089 (6) −0.0004 (6)
C22 0.0532 (9) 0.0523 (9) 0.0375 (7) 0.0025 (7) 0.0093 (6) 0.0007 (7)
C23 0.0696 (11) 0.0717 (12) 0.0422 (9) 0.0004 (9) 0.0182 (8) −0.0069 (8)
C24 0.0610 (11) 0.0838 (14) 0.0703 (12) −0.0019 (10) 0.0314 (10) −0.0169 (11)
C25 0.0408 (9) 0.0878 (14) 0.0816 (13) 0.0024 (9) 0.0144 (9) −0.0132 (11)
C26 0.0400 (8) 0.0695 (11) 0.0543 (9) −0.0039 (8) 0.0058 (7) −0.0040 (8)
O22 0.0696 (7) 0.0899 (10) 0.0349 (6) 0.0288 (7) −0.0039 (5) −0.0076 (6)
C27 0.0843 (13) 0.0919 (15) 0.0406 (9) 0.0168 (12) −0.0106 (9) −0.0046 (9)
C31 0.0456 (8) 0.0401 (8) 0.0318 (7) 0.0060 (6) 0.0049 (6) 0.0060 (6)
C32 0.0504 (9) 0.0470 (8) 0.0359 (7) −0.0014 (7) −0.0010 (6) 0.0003 (6)
C33 0.0392 (8) 0.0526 (9) 0.0454 (8) −0.0017 (7) 0.0052 (6) 0.0076 (7)
C34 0.0467 (8) 0.0430 (8) 0.0360 (7) 0.0057 (7) 0.0121 (6) 0.0071 (6)
C35 0.0498 (9) 0.0438 (8) 0.0385 (7) −0.0012 (7) 0.0044 (6) −0.0019 (6)
C36 0.0402 (8) 0.0468 (8) 0.0432 (8) 0.0014 (7) 0.0046 (6) 0.0019 (7)
C37 0.0556 (9) 0.0455 (8) 0.0372 (7) 0.0100 (7) 0.0089 (7) 0.0053 (7)
O31 0.0698 (8) 0.0835 (9) 0.0428 (6) 0.0201 (7) 0.0044 (6) −0.0148 (6)
O32 0.0520 (7) 0.0674 (8) 0.0526 (7) 0.0152 (6) 0.0111 (5) 0.0023 (6)
N34 0.0606 (9) 0.0598 (9) 0.0456 (7) 0.0109 (7) 0.0207 (6) 0.0082 (7)
O41 0.0611 (8) 0.1020 (11) 0.0923 (10) 0.0029 (8) 0.0395 (7) −0.0035 (9)
O42 0.0905 (10) 0.0772 (9) 0.0558 (7) 0.0075 (8) 0.0258 (7) −0.0159 (7)