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. 2023 Jun 13;79(Pt 7):626–632. doi: 10.1107/S205698902300498X
U11 U22 U33 U12 U13 U23
Fe1 0.0222 (2) 0.0168 (2) 0.0200 (3) −0.00091 (18) 0.0003 (3) 0.0004 (2)
O1 0.0310 (14) 0.0216 (11) 0.0215 (15) 0.0005 (10) −0.0023 (11) −0.0012 (10)
N1 0.0261 (17) 0.0258 (15) 0.026 (2) −0.0001 (12) 0.0045 (14) −0.0020 (13)
N2 0.0252 (16) 0.0279 (15) 0.030 (2) −0.0020 (13) −0.0012 (15) 0.0070 (15)
N3 0.0288 (14) 0.0203 (12) 0.0273 (16) −0.0042 (10) −0.0006 (15) 0.0011 (14)
C1 0.0249 (19) 0.0188 (15) 0.034 (3) −0.0028 (14) −0.0081 (18) 0.0025 (15)
C2 0.0270 (19) 0.0181 (15) 0.027 (2) −0.0033 (13) −0.0001 (17) −0.0010 (14)
C3 0.0262 (16) 0.0259 (15) 0.0197 (18) 0.0019 (12) −0.0009 (17) 0.0007 (16)
C4 0.0197 (17) 0.0207 (15) 0.025 (2) −0.0003 (13) −0.0009 (15) −0.0027 (14)
C5 0.0188 (14) 0.0172 (13) 0.0270 (19) −0.0026 (10) 0.0010 (17) −0.0038 (16)
C6 0.0177 (16) 0.0190 (14) 0.023 (2) −0.0017 (12) 0.0010 (14) 0.0010 (14)
C7 0.0219 (16) 0.0192 (14) 0.021 (2) 0.0002 (12) −0.0009 (13) −0.0009 (13)
C8 0.0195 (17) 0.0179 (15) 0.026 (2) 0.0014 (12) −0.0052 (14) 0.0002 (14)
C9 0.0290 (16) 0.0202 (14) 0.0206 (19) −0.0010 (12) −0.0047 (17) −0.0004 (16)
C10 0.0296 (19) 0.0218 (16) 0.030 (2) −0.0014 (14) −0.0023 (16) −0.0044 (15)
C11 0.041 (2) 0.0235 (17) 0.037 (2) 0.0063 (15) −0.0090 (18) −0.0079 (16)
C12 0.053 (3) 0.0182 (15) 0.035 (3) 0.0018 (16) −0.0157 (19) 0.0020 (15)
C13 0.053 (3) 0.0231 (16) 0.024 (2) −0.0080 (17) −0.0036 (19) 0.0026 (16)
C14 0.039 (2) 0.0248 (17) 0.026 (2) −0.0059 (15) 0.0000 (17) −0.0030 (15)
C15 0.0235 (17) 0.0185 (14) 0.025 (2) −0.0040 (12) −0.0021 (16) −0.0019 (14)
C16 0.0270 (18) 0.0222 (15) 0.026 (2) −0.0022 (13) 0.0007 (15) 0.0008 (14)
C17 0.035 (2) 0.0249 (16) 0.027 (2) −0.0061 (15) −0.0033 (16) 0.0035 (15)
C18 0.038 (2) 0.0278 (17) 0.020 (2) −0.0089 (15) 0.0047 (17) −0.0019 (15)
C19 0.0304 (19) 0.0258 (17) 0.029 (2) −0.0030 (15) 0.0060 (16) −0.0047 (15)
C20 0.0244 (18) 0.0217 (15) 0.026 (2) −0.0017 (13) 0.0018 (15) 0.0004 (14)
C21 0.0255 (18) 0.0170 (14) 0.026 (2) −0.0030 (13) 0.0003 (15) 0.0006 (14)
C22 0.032 (2) 0.0230 (16) 0.024 (2) −0.0008 (14) 0.0003 (16) 0.0015 (14)
C23 0.044 (2) 0.0198 (15) 0.025 (2) −0.0057 (15) 0.0055 (17) −0.0016 (15)
C24 0.046 (2) 0.0188 (15) 0.032 (2) −0.0007 (15) 0.0160 (19) −0.0039 (15)
C25 0.031 (2) 0.0255 (17) 0.038 (3) 0.0020 (15) 0.0082 (18) 0.0041 (16)
C26 0.0271 (18) 0.0208 (15) 0.033 (2) 0.0017 (14) 0.0005 (16) 0.0017 (15)
C27 0.0231 (18) 0.0234 (16) 0.026 (2) −0.0006 (13) 0.0033 (15) −0.0002 (14)
C28 0.034 (2) 0.0219 (16) 0.028 (2) 0.0001 (15) 0.0001 (17) 0.0010 (15)
C29 0.045 (2) 0.0189 (15) 0.029 (2) 0.0008 (15) −0.0017 (18) 0.0030 (15)
C30 0.057 (3) 0.0260 (18) 0.032 (3) 0.0050 (18) −0.005 (2) 0.0089 (16)
C31 0.052 (3) 0.0304 (18) 0.023 (2) 0.0019 (18) −0.005 (2) 0.0032 (17)
C32 0.034 (2) 0.0227 (16) 0.025 (2) 0.0029 (14) −0.0006 (16) −0.0026 (15)
C33 0.0279 (19) 0.0210 (15) 0.025 (2) −0.0031 (13) 0.0051 (16) −0.0022 (14)
C34 0.036 (2) 0.0228 (16) 0.025 (2) −0.0030 (15) −0.0001 (17) −0.0035 (14)
C35 0.043 (3) 0.039 (2) 0.036 (3) 0.0051 (19) −0.007 (2) 0.0013 (18)
C36 0.052 (3) 0.0286 (19) 0.028 (2) −0.0115 (18) 0.006 (2) −0.0041 (17)
C37 0.048 (3) 0.031 (2) 0.043 (3) −0.0051 (18) 0.022 (2) −0.0098 (19)
C38 0.031 (2) 0.0283 (18) 0.051 (3) −0.0012 (16) 0.009 (2) −0.0083 (18)
C39 0.0281 (19) 0.0234 (16) 0.038 (3) 0.0002 (14) 0.0027 (17) −0.0037 (16)
C40 0.043 (3) 0.043 (2) 0.045 (3) 0.008 (2) −0.010 (2) −0.002 (2)
C41 0.0236 (19) 0.0289 (17) 0.026 (2) −0.0015 (14) −0.0038 (16) 0.0023 (16)
C42 0.0234 (18) 0.0296 (18) 0.035 (2) 0.0001 (14) −0.0050 (17) 0.0051 (17)
C43 0.050 (3) 0.032 (2) 0.048 (3) 0.0078 (18) −0.003 (2) −0.006 (2)
C44 0.033 (2) 0.037 (2) 0.049 (3) −0.0057 (17) −0.009 (2) 0.016 (2)
C45 0.034 (2) 0.075 (3) 0.029 (3) −0.009 (2) −0.0069 (19) 0.014 (3)
C46 0.038 (2) 0.069 (3) 0.029 (3) 0.003 (2) −0.005 (2) −0.012 (2)
C47 0.032 (2) 0.042 (2) 0.032 (3) 0.0019 (18) −0.0067 (19) −0.008 (2)
C48 0.068 (4) 0.050 (3) 0.062 (4) 0.021 (3) −0.024 (3) −0.026 (3)
C49 0.0253 (17) 0.0208 (16) 0.029 (2) −0.0012 (13) −0.0029 (15) 0.0063 (14)
C50 0.0263 (18) 0.0222 (16) 0.033 (2) 0.0015 (13) −0.0022 (15) 0.0013 (15)
C51 0.035 (2) 0.0312 (19) 0.034 (3) −0.0050 (16) 0.0024 (18) −0.0064 (17)
C52 0.0310 (18) 0.0212 (14) 0.045 (2) −0.0027 (12) 0.002 (2) −0.0024 (18)
C53 0.0257 (19) 0.0243 (17) 0.049 (3) −0.0022 (15) 0.0031 (18) 0.0094 (17)
C54 0.031 (2) 0.0333 (19) 0.034 (3) −0.0034 (15) 0.0037 (17) 0.0109 (18)
C55 0.033 (2) 0.0288 (18) 0.031 (2) −0.0020 (15) −0.0021 (17) 0.0040 (16)
C56 0.057 (3) 0.045 (2) 0.029 (3) −0.012 (2) 0.004 (2) −0.002 (2)