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. 2020 Oct 30;76(Pt 11):1779–1793. doi: 10.1107/S2056989020014097
U11 U22 U33 U12 U13 U23
N1 0.0415 (17) 0.0396 (15) 0.0344 (17) −0.0058 (17) 0.0099 (16) −0.0041 (12)
C2 0.048 (2) 0.044 (2) 0.035 (2) 0.0010 (17) 0.0020 (18) 0.0005 (17)
C3 0.0376 (18) 0.0328 (18) 0.035 (2) −0.0018 (16) −0.0022 (16) −0.0011 (16)
N4 0.0320 (15) 0.0302 (15) 0.0348 (18) −0.0001 (13) −0.0053 (13) 0.0004 (13)
C5 0.037 (2) 0.0373 (19) 0.033 (2) −0.0035 (15) −0.0070 (15) 0.0017 (15)
C6 0.0376 (19) 0.045 (2) 0.051 (2) −0.0019 (17) −0.0041 (18) 0.0004 (19)
C21 0.0355 (18) 0.0291 (16) 0.031 (2) 0.0035 (15) 0.0023 (16) −0.0034 (15)
C22 0.0340 (17) 0.0379 (17) 0.034 (2) −0.0008 (18) −0.0025 (18) −0.0017 (14)
C23 0.041 (2) 0.057 (2) 0.050 (3) −0.0128 (19) −0.0041 (18) 0.001 (2)
C24 0.051 (2) 0.069 (3) 0.052 (3) −0.017 (2) 0.006 (2) 0.014 (2)
C25 0.045 (2) 0.070 (2) 0.0304 (19) −0.005 (2) 0.0032 (18) 0.0057 (17)
C26 0.039 (2) 0.045 (2) 0.034 (2) −0.0004 (17) −0.0016 (17) −0.0041 (17)
O22 0.0488 (14) 0.0450 (12) 0.0297 (13) −0.0095 (13) −0.0065 (13) −0.0008 (10)
C27 0.059 (2) 0.061 (3) 0.039 (2) −0.008 (2) −0.0174 (19) −0.0053 (19)
C31 0.0362 (19) 0.046 (2) 0.025 (2) −0.0065 (16) 0.0051 (15) −0.0024 (15)
C32 0.0384 (19) 0.065 (2) 0.030 (2) −0.0035 (17) 0.0008 (16) 0.0064 (19)
Br32 0.0640 (3) 0.0691 (3) 0.0907 (4) 0.0123 (3) −0.0067 (3) 0.0203 (3)
C33 0.045 (2) 0.107 (4) 0.037 (2) −0.014 (3) −0.0080 (19) 0.012 (2)
C34 0.070 (3) 0.103 (4) 0.040 (3) −0.045 (3) 0.006 (2) −0.022 (3)
C35 0.087 (3) 0.060 (3) 0.058 (3) −0.023 (3) 0.016 (3) −0.015 (2)
C36 0.058 (2) 0.051 (2) 0.049 (3) −0.004 (2) 0.002 (2) −0.006 (2)
C37 0.0325 (19) 0.048 (2) 0.039 (2) 0.0034 (17) −0.0004 (17) −0.0047 (18)
O31 0.0475 (14) 0.0471 (14) 0.0283 (14) −0.0077 (12) 0.0019 (12) −0.0046 (12)
O32 0.0561 (18) 0.131 (3) 0.0509 (17) −0.044 (2) 0.0165 (16) −0.0198 (16)