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. 2023 Oct 5;79(Pt 11):993–998. doi: 10.1107/S2056989023008654
U11 U22 U33 U12 U13 U23
C1 0.0320 (9) 0.0589 (11) 0.0314 (9) −0.0018 (8) 0.0020 (7) −0.0014 (8)
C2 0.0327 (9) 0.0625 (12) 0.0337 (9) −0.0045 (8) −0.0002 (7) 0.0005 (8)
C3 0.0337 (9) 0.0606 (12) 0.0358 (9) −0.0037 (9) 0.0015 (7) 0.0006 (9)
C4 0.0326 (9) 0.0575 (12) 0.0407 (10) −0.0026 (8) 0.0018 (7) 0.0101 (9)
C5 0.0445 (12) 0.0656 (14) 0.0596 (13) −0.0060 (10) −0.0040 (10) 0.0032 (11)
C6 0.0551 (15) 0.0816 (18) 0.0838 (18) −0.0223 (14) −0.0209 (14) 0.0151 (15)
C7 0.0348 (12) 0.094 (2) 0.100 (2) −0.0080 (13) −0.0040 (13) 0.0419 (18)
C8 0.0416 (13) 0.097 (2) 0.0858 (19) 0.0078 (13) 0.0206 (13) 0.0207 (17)
C9 0.0445 (12) 0.0805 (17) 0.0594 (14) −0.0030 (11) 0.0151 (10) −0.0011 (12)
C10 0.0314 (9) 0.0475 (10) 0.0343 (9) 0.0002 (7) 0.0017 (7) −0.0005 (7)
C11 0.0351 (9) 0.0486 (10) 0.0354 (9) 0.0000 (8) −0.0029 (7) 0.0001 (8)
C12 0.0446 (11) 0.0557 (12) 0.0396 (10) −0.0024 (9) 0.0016 (8) −0.0032 (9)
C13 0.0578 (13) 0.0596 (13) 0.0499 (12) −0.0054 (11) −0.0067 (10) −0.0103 (10)
C14 0.0443 (12) 0.0655 (14) 0.0650 (14) −0.0103 (10) −0.0128 (10) −0.0005 (11)
C15 0.0341 (10) 0.0826 (17) 0.0624 (14) −0.0034 (11) 0.0010 (10) −0.0032 (12)
C16 0.0361 (10) 0.0735 (14) 0.0453 (11) 0.0009 (10) 0.0016 (8) −0.0096 (10)
C17 0.0360 (9) 0.0542 (11) 0.0347 (9) −0.0016 (8) 0.0036 (7) −0.0037 (8)
C18 0.0356 (9) 0.0542 (11) 0.0392 (10) −0.0007 (8) 0.0053 (8) −0.0008 (8)
C19 0.0413 (10) 0.0586 (12) 0.0420 (10) −0.0018 (9) 0.0078 (8) −0.0009 (9)
C20 0.0390 (10) 0.0505 (11) 0.0471 (11) 0.0018 (8) 0.0116 (8) 0.0071 (9)
C21 0.0415 (11) 0.0609 (13) 0.0516 (12) 0.0024 (10) 0.0072 (9) 0.0081 (10)
C22 0.0468 (13) 0.0740 (16) 0.0722 (16) −0.0050 (12) −0.0071 (11) 0.0167 (13)
C23 0.0379 (12) 0.0804 (18) 0.096 (2) 0.0040 (12) 0.0149 (13) 0.0283 (16)
C24 0.0539 (14) 0.0804 (18) 0.089 (2) 0.0055 (13) 0.0362 (14) 0.0086 (16)
C25 0.0539 (14) 0.0782 (16) 0.0645 (15) −0.0027 (12) 0.0246 (11) −0.0050 (13)
C26 0.0315 (9) 0.0554 (11) 0.0351 (9) −0.0013 (8) 0.0021 (7) −0.0016 (8)
C27 0.0323 (9) 0.0553 (12) 0.0488 (11) 0.0009 (8) −0.0040 (8) −0.0101 (9)
C28 0.0631 (15) 0.0751 (16) 0.0582 (14) −0.0127 (13) −0.0205 (12) 0.0074 (12)
C29 0.084 (2) 0.095 (2) 0.083 (2) −0.0132 (18) −0.0477 (17) 0.0046 (17)
C30 0.0520 (15) 0.089 (2) 0.109 (2) −0.0128 (14) −0.0269 (16) −0.0201 (18)
C31 0.0566 (15) 0.087 (2) 0.098 (2) −0.0283 (14) 0.0074 (15) −0.0243 (17)
C32 0.0520 (13) 0.0787 (16) 0.0592 (14) −0.0154 (12) 0.0031 (11) −0.0121 (12)
N1 0.0299 (7) 0.0523 (9) 0.0303 (7) −0.0014 (6) 0.0009 (6) −0.0023 (6)
N2 0.0324 (8) 0.0645 (10) 0.0316 (8) −0.0058 (7) 0.0017 (6) −0.0059 (7)
N3 0.0348 (8) 0.0659 (11) 0.0319 (8) −0.0070 (8) 0.0045 (6) −0.0067 (7)
N4 0.0304 (7) 0.0496 (9) 0.0349 (8) −0.0023 (7) 0.0030 (6) −0.0023 (7)
N5 0.0322 (8) 0.0646 (11) 0.0342 (8) −0.0057 (7) 0.0027 (6) −0.0055 (7)
N6 0.0341 (8) 0.0878 (14) 0.0346 (8) −0.0110 (9) 0.0028 (7) −0.0081 (8)
Pd1 0.02574 (7) 0.04563 (8) 0.03007 (7) −0.00040 (5) 0.00212 (5) −0.00124 (5)
S1 0.0344 (2) 0.0749 (3) 0.0349 (2) −0.0119 (2) 0.00699 (18) −0.0100 (2)
S2 0.0275 (2) 0.0866 (4) 0.0319 (2) −0.0068 (2) 0.00370 (17) −0.0071 (2)