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. 2024 Jul 9;80(Pt 8):840–844. doi: 10.1107/S205698902400642X
U11 U22 U33 U12 U13 U23
S1 0.0135 (3) 0.0121 (3) 0.0179 (3) 0.0021 (2) 0.0043 (2) 0.0012 (2)
S2 0.0140 (3) 0.0113 (3) 0.0270 (4) −0.0012 (2) 0.0083 (3) −0.0004 (2)
O5 0.0221 (10) 0.0170 (9) 0.0228 (11) 0.0007 (8) 0.0104 (8) −0.0003 (8)
O10 0.0124 (10) 0.0129 (10) 0.0327 (12) −0.0020 (8) 0.0079 (8) 0.0022 (8)
O4 0.0193 (10) 0.0115 (9) 0.0376 (12) 0.0007 (8) 0.0100 (9) −0.0005 (8)
O7 0.0270 (12) 0.0331 (11) 0.0216 (11) −0.0145 (10) 0.0027 (9) −0.0034 (9)
O6 0.0117 (10) 0.0142 (10) 0.0321 (12) 0.0006 (8) 0.0054 (8) 0.0000 (8)
N11 0.0166 (11) 0.0136 (11) 0.0202 (12) 0.0000 (9) 0.0030 (9) 0.0005 (9)
O3 0.0270 (12) 0.0286 (12) 0.0185 (11) 0.0128 (9) 0.0012 (9) 0.0007 (8)
N14 0.0237 (13) 0.0207 (12) 0.0239 (14) −0.0030 (10) 0.0041 (10) −0.0013 (10)
O9 0.0251 (11) 0.0316 (11) 0.0205 (11) −0.0083 (9) 0.0076 (9) 0.0026 (9)
N18 0.0251 (14) 0.0240 (14) 0.0335 (16) 0.0010 (11) −0.0006 (11) −0.0050 (11)
N12 0.0142 (11) 0.0127 (11) 0.0188 (12) −0.0001 (9) 0.0029 (9) −0.0001 (9)
N17 0.0303 (14) 0.0248 (13) 0.0229 (13) −0.0001 (11) −0.0010 (11) 0.0038 (10)
N13 0.0297 (14) 0.0218 (13) 0.0231 (14) −0.0044 (10) 0.0052 (11) 0.0012 (10)
C25 0.0125 (12) 0.0147 (13) 0.0128 (12) −0.0001 (10) 0.0035 (10) 0.0009 (10)
N16 0.0447 (17) 0.0249 (13) 0.0179 (13) −0.0064 (12) −0.0008 (12) −0.0001 (10)
N15 0.0263 (14) 0.0231 (13) 0.0275 (14) −0.0001 (11) 0.0036 (11) −0.0002 (10)
C30 0.0120 (13) 0.0159 (13) 0.0178 (14) −0.0007 (11) 0.0029 (10) 0.0012 (11)
N20 0.0382 (16) 0.0294 (14) 0.0225 (14) −0.0068 (12) 0.0081 (12) 0.0030 (10)
C29 0.0135 (13) 0.0158 (13) 0.0132 (13) 0.0016 (10) 0.0029 (10) 0.0012 (10)
N19 0.0289 (15) 0.0246 (13) 0.0264 (14) −0.0010 (11) 0.0014 (11) −0.0038 (10)
C35 0.0134 (13) 0.0174 (13) 0.0165 (14) −0.0010 (11) 0.0035 (10) 0.0008 (10)
O8 0.0219 (12) 0.0115 (10) 0.100 (2) −0.0016 (9) 0.0251 (13) −0.0010 (12)
C48 0.0210 (15) 0.0243 (15) 0.0199 (15) 0.0037 (12) −0.0001 (12) 0.0005 (12)
C23 0.0158 (12) 0.0119 (13) 0.0220 (14) −0.0004 (11) 0.0037 (11) 0.0004 (10)
C24 0.0167 (14) 0.0138 (13) 0.0167 (14) 0.0028 (11) 0.0039 (11) 0.0014 (10)
C27 0.0133 (13) 0.0160 (13) 0.0295 (16) −0.0032 (11) 0.0045 (11) 0.0022 (11)
C26 0.0157 (14) 0.0149 (13) 0.0190 (14) 0.0032 (10) 0.0057 (11) −0.0009 (10)
C34 0.0128 (13) 0.0163 (13) 0.0119 (12) −0.0005 (11) 0.0023 (10) −0.0003 (10)
C49 0.0241 (15) 0.0249 (15) 0.0182 (14) 0.0009 (12) 0.0039 (11) 0.0013 (11)
C31 0.0110 (14) 0.0170 (13) 0.0308 (17) 0.0032 (11) 0.0070 (11) 0.0025 (11)
C38 0.0131 (13) 0.0130 (12) 0.0129 (12) −0.0002 (10) 0.0026 (10) 0.0004 (10)
C28 0.0178 (14) 0.0130 (13) 0.0274 (16) −0.0008 (10) 0.0017 (12) 0.0014 (11)
C33 0.0144 (13) 0.0148 (13) 0.0172 (14) −0.0010 (11) 0.0048 (10) 0.0006 (10)
C61 0.0237 (15) 0.0239 (15) 0.0160 (14) −0.0009 (12) 0.0015 (11) −0.0010 (11)
C54 0.0199 (14) 0.0267 (15) 0.0185 (14) 0.0022 (12) 0.0016 (11) −0.0023 (11)
C36 0.0139 (14) 0.0169 (13) 0.0248 (15) 0.0034 (11) 0.0050 (11) 0.0003 (11)
C62 0.0217 (15) 0.0281 (15) 0.0212 (15) 0.0027 (12) 0.0039 (12) 0.0021 (12)
C60 0.0259 (16) 0.0286 (16) 0.0219 (15) 0.0012 (13) 0.0028 (12) 0.0012 (13)
C50 0.0241 (15) 0.0269 (15) 0.0218 (15) 0.0011 (12) 0.0006 (12) −0.0047 (12)
C22 0.0143 (14) 0.0179 (14) 0.0272 (16) −0.0007 (11) 0.0075 (12) −0.0005 (11)
C40 0.0195 (14) 0.0254 (15) 0.0172 (14) 0.0003 (11) 0.0021 (11) −0.0011 (11)
C53 0.0211 (15) 0.0280 (16) 0.0270 (17) 0.0036 (12) 0.0019 (12) 0.0001 (12)
C37 0.0158 (13) 0.0102 (12) 0.0295 (16) 0.0012 (10) 0.0054 (11) 0.0003 (11)
C42 0.0231 (15) 0.0290 (16) 0.0176 (14) 0.0013 (12) 0.0064 (11) 0.0005 (12)
C41 0.0191 (14) 0.0202 (14) 0.0206 (15) 0.0024 (11) 0.0030 (11) 0.0029 (11)
C21 0.0129 (13) 0.0157 (13) 0.0154 (13) 0.0024 (11) 0.0038 (10) 0.0006 (11)
C47 0.0239 (15) 0.0266 (15) 0.0198 (15) 0.0037 (12) 0.0020 (11) −0.0034 (11)
C64 0.0304 (17) 0.0340 (17) 0.0237 (16) 0.0047 (14) 0.0033 (13) −0.0076 (13)
C55 0.0187 (14) 0.0223 (14) 0.0229 (16) 0.0049 (11) −0.0001 (12) −0.0012 (11)
C52 0.0371 (19) 0.0279 (17) 0.0296 (18) −0.0070 (14) 0.0044 (14) 0.0041 (13)
C63 0.0316 (17) 0.0341 (17) 0.0196 (16) 0.0034 (14) 0.0070 (13) −0.0004 (13)
C44 0.0347 (18) 0.0234 (15) 0.0319 (18) −0.0074 (13) 0.0052 (14) −0.0007 (13)
C46 0.0219 (15) 0.0311 (16) 0.0218 (15) 0.0003 (13) 0.0034 (12) 0.0040 (12)
C43 0.0228 (15) 0.0260 (15) 0.0222 (15) −0.0002 (12) 0.0035 (12) −0.0037 (12)
C39 0.0256 (16) 0.0233 (15) 0.0205 (15) 0.0013 (12) 0.0053 (12) 0.0007 (12)
C32 0.0200 (14) 0.0115 (13) 0.0309 (17) 0.0023 (11) 0.0096 (12) 0.0016 (11)
C56 0.0258 (16) 0.0296 (16) 0.0194 (15) 0.0044 (13) 0.0023 (12) −0.0015 (12)
C58 0.0369 (19) 0.0261 (16) 0.0303 (18) −0.0032 (14) −0.0025 (14) −0.0027 (13)
C57 0.0275 (16) 0.0318 (17) 0.0254 (16) 0.0057 (13) −0.0024 (13) −0.0090 (13)
C66 0.038 (2) 0.0373 (19) 0.0331 (19) −0.0040 (15) 0.0117 (15) 0.0101 (15)
C51 0.042 (2) 0.0318 (18) 0.0269 (18) −0.0040 (15) −0.0022 (15) −0.0051 (14)
C45 0.0344 (18) 0.0333 (17) 0.0287 (18) −0.0062 (14) 0.0100 (14) 0.0082 (13)
C65 0.0346 (19) 0.0261 (16) 0.0348 (19) −0.0073 (13) 0.0054 (15) −0.0003 (13)
C59 0.0352 (19) 0.0381 (19) 0.0317 (19) −0.0014 (15) 0.0023 (14) 0.0119 (15)