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. 2021 Jun 30;77(Pt 7):749–754. doi: 10.1107/S2056989021006381
U11 U22 U33 U12 U13 U23
Re1 0.0446 (2) 0.0355 (2) 0.02719 (18) −0.00580 (16) 0.00707 (14) −0.00453 (14)
Ru1 0.0259 (3) 0.0327 (3) 0.0212 (3) −0.0019 (3) 0.0033 (2) 0.0023 (3)
Ru2 0.0300 (3) 0.0349 (4) 0.0180 (3) 0.0006 (3) 0.0031 (2) −0.0007 (3)
Br1 0.0624 (6) 0.0696 (7) 0.0382 (5) −0.0096 (5) −0.0010 (4) −0.0183 (5)
Br2 0.0934 (8) 0.0612 (7) 0.0558 (6) −0.0312 (6) 0.0394 (6) −0.0125 (5)
Br3 0.0914 (8) 0.0437 (6) 0.0345 (5) −0.0140 (5) −0.0078 (5) −0.0047 (4)
Br4 0.0577 (6) 0.0529 (6) 0.0480 (6) −0.0077 (5) 0.0184 (4) 0.0064 (4)
P1 0.0280 (10) 0.0299 (11) 0.0227 (10) −0.0032 (9) 0.0056 (8) −0.0018 (8)
P2 0.0303 (10) 0.0297 (11) 0.0330 (11) −0.0023 (9) 0.0010 (8) 0.0038 (9)
P3 0.0303 (10) 0.0310 (11) 0.0222 (10) 0.0000 (9) 0.0054 (8) 0.0006 (8)
P4 0.0339 (11) 0.0292 (11) 0.0242 (10) 0.0016 (9) 0.0038 (8) 0.0049 (8)
O101 0.093 (7) 0.097 (8) 0.141 (10) 0.045 (6) 0.028 (6) 0.009 (7)
N1 0.037 (4) 0.046 (5) 0.044 (4) 0.003 (4) 0.002 (3) 0.003 (4)
N2 0.063 (5) 0.046 (5) 0.045 (5) 0.015 (4) −0.005 (4) −0.015 (4)
N3 0.056 (5) 0.047 (5) 0.051 (5) 0.014 (4) 0.018 (4) 0.022 (4)
N4 0.043 (4) 0.033 (4) 0.082 (7) −0.010 (4) −0.007 (4) 0.010 (4)
N6 0.102 (8) 0.053 (6) 0.056 (6) −0.038 (6) 0.007 (5) −0.019 (5)
N7 0.064 (5) 0.047 (5) 0.030 (4) 0.024 (4) 0.006 (3) 0.006 (3)
N8 0.037 (4) 0.030 (4) 0.048 (4) 0.009 (3) 0.007 (3) 0.003 (3)
N9 0.030 (4) 0.049 (4) 0.037 (4) 0.004 (3) 0.005 (3) 0.005 (3)
N10 0.091 (7) 0.053 (6) 0.047 (5) −0.018 (5) 0.018 (5) −0.010 (4)
N11 0.104 (8) 0.040 (5) 0.078 (7) 0.010 (5) −0.013 (6) 0.008 (5)
N12 0.067 (6) 0.050 (6) 0.093 (8) −0.018 (5) 0.032 (5) −0.013 (5)
C10 0.072 (8) 0.048 (7) 0.087 (9) −0.025 (6) −0.029 (7) −0.001 (6)
C11 0.083 (9) 0.055 (8) 0.127 (13) −0.015 (7) 0.023 (8) −0.051 (8)
N13 0.031 (4) 0.034 (4) 0.039 (4) 0.001 (3) −0.005 (3) −0.003 (3)
N101 0.053 (5) 0.062 (6) 0.054 (5) −0.006 (5) 0.011 (4) −0.003 (4)
C1 0.032 (4) 0.050 (6) 0.046 (5) 0.000 (4) 0.002 (4) 0.018 (4)
C2 0.051 (5) 0.038 (5) 0.048 (5) 0.009 (4) 0.022 (4) 0.012 (4)
C3 0.060 (6) 0.041 (5) 0.047 (6) 0.009 (5) −0.011 (5) −0.020 (4)
C7 0.038 (5) 0.045 (6) 0.075 (7) −0.010 (4) 0.009 (5) 0.010 (5)
C8 0.082 (7) 0.051 (6) 0.037 (5) −0.030 (6) 0.008 (5) −0.015 (5)
C9 0.052 (6) 0.030 (5) 0.097 (9) −0.002 (5) −0.014 (6) 0.000 (5)
N5 0.062 (6) 0.027 (5) 0.111 (9) 0.005 (4) −0.012 (5) −0.007 (5)
C4 0.051 (5) 0.051 (6) 0.036 (5) 0.013 (5) −0.004 (4) −0.003 (4)
C5 0.055 (6) 0.062 (7) 0.050 (6) 0.026 (5) 0.018 (5) −0.003 (5)
C6 0.058 (6) 0.033 (5) 0.089 (9) 0.001 (5) 0.005 (6) 0.001 (5)
C12 0.081 (8) 0.021 (5) 0.083 (8) −0.016 (5) −0.001 (6) 0.007 (5)
C13 0.060 (6) 0.040 (5) 0.030 (5) 0.019 (4) 0.013 (4) −0.001 (4)
C14 0.040 (5) 0.037 (5) 0.037 (5) 0.001 (4) 0.008 (4) −0.001 (4)
C15 0.031 (4) 0.039 (5) 0.034 (5) 0.001 (4) 0.002 (3) −0.005 (4)
C16 0.055 (6) 0.046 (6) 0.048 (6) 0.016 (5) 0.019 (4) 0.022 (5)
C17 0.038 (5) 0.053 (6) 0.047 (6) 0.007 (4) −0.014 (4) 0.001 (5)
C18 0.042 (5) 0.031 (5) 0.052 (6) 0.009 (4) 0.013 (4) 0.006 (4)
C19 0.091 (8) 0.057 (7) 0.036 (5) −0.030 (6) 0.016 (5) −0.008 (5)
C20 0.102 (9) 0.043 (6) 0.064 (8) 0.016 (6) −0.030 (7) 0.003 (5)
C21 0.056 (6) 0.041 (6) 0.122 (11) −0.014 (5) 0.044 (7) −0.008 (6)
C22 0.076 (8) 0.043 (6) 0.062 (7) −0.011 (6) −0.018 (6) 0.008 (5)
C23 0.072 (8) 0.067 (8) 0.091 (10) −0.012 (7) 0.029 (7) −0.038 (7)
C24 0.171 (15) 0.040 (7) 0.054 (7) −0.015 (8) 0.032 (8) 0.019 (5)
C25 0.018 (3) 0.029 (4) 0.022 (4) −0.005 (3) 0.007 (3) 0.005 (3)
C26 0.057 (6) 0.044 (5) 0.031 (5) −0.013 (5) −0.003 (4) −0.005 (4)
C27 0.048 (5) 0.083 (8) 0.027 (5) 0.001 (5) 0.007 (4) −0.006 (5)
C28 0.075 (7) 0.054 (6) 0.029 (5) −0.016 (6) 0.002 (5) 0.014 (4)
C29 0.044 (5) 0.052 (6) 0.033 (5) 0.010 (5) −0.004 (4) 0.003 (4)
C30 0.035 (5) 0.083 (8) 0.027 (5) −0.009 (5) −0.006 (4) 0.002 (5)
C31 0.049 (6) 0.093 (9) 0.038 (6) −0.004 (6) −0.001 (4) −0.023 (6)
C32 0.084 (8) 0.061 (7) 0.040 (6) −0.020 (7) 0.008 (5) −0.023 (5)
C33 0.080 (8) 0.090 (9) 0.027 (5) 0.048 (7) −0.005 (5) −0.018 (5)
C34 0.078 (8) 0.128 (12) 0.014 (5) −0.028 (8) 0.002 (5) 0.008 (6)
C35 0.076 (8) 0.069 (8) 0.033 (5) 0.011 (6) −0.022 (5) −0.010 (5)
O1M 0.056 (4) 0.038 (4) 0.066 (5) −0.001 (3) 0.004 (3) −0.006 (3)
C1EB 0.067 (7) 0.067 (7) 0.093 (9) −0.012 (6) 0.017 (6) −0.002 (6)
C2E 0.067 (7) 0.067 (7) 0.093 (9) −0.012 (6) 0.017 (6) −0.002 (6)
C1EA 0.067 (7) 0.067 (7) 0.093 (9) −0.012 (6) 0.017 (6) −0.002 (6)