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. 2014 Aug 1;70(Pt 9):o968–o969. doi: 10.1107/S1600536814017188
U11 U22 U33 U12 U13 U23
C1 0.0378 (18) 0.0460 (16) 0.0330 (14) −0.0027 (13) 0.0123 (13) 0.0018 (13)
C2 0.049 (2) 0.0473 (17) 0.0288 (14) 0.0025 (14) 0.0084 (13) 0.0054 (12)
C3 0.0397 (18) 0.0415 (15) 0.0365 (15) −0.0016 (13) 0.0128 (13) 0.0067 (12)
C4 0.0403 (18) 0.0393 (14) 0.0298 (14) −0.0037 (13) 0.0094 (12) 0.0000 (12)
C5 0.0362 (17) 0.0420 (15) 0.0330 (14) −0.0041 (13) 0.0103 (12) 0.0019 (12)
C11 0.0382 (18) 0.0517 (17) 0.0380 (16) −0.0058 (14) 0.0093 (13) −0.0024 (13)
C12 0.054 (2) 0.0600 (18) 0.0271 (14) −0.0014 (15) 0.0083 (14) −0.0045 (14)
C13 0.059 (2) 0.088 (3) 0.0347 (17) −0.005 (2) 0.0078 (16) −0.0043 (17)
C14 0.076 (3) 0.075 (2) 0.0419 (18) −0.001 (2) 0.0139 (18) −0.0232 (17)
C31 0.0467 (19) 0.0402 (15) 0.0285 (14) 0.0000 (13) 0.0038 (13) 0.0009 (12)
C32 0.062 (2) 0.0500 (19) 0.0537 (19) −0.0032 (16) 0.0163 (17) 0.0094 (15)
C33 0.087 (3) 0.0421 (19) 0.071 (2) −0.0048 (19) 0.012 (2) 0.0172 (17)
C34 0.086 (3) 0.046 (2) 0.080 (3) 0.011 (2) 0.013 (2) 0.0019 (18)
C35 0.070 (3) 0.057 (2) 0.066 (2) 0.0158 (18) 0.0176 (19) −0.0031 (18)
C36 0.051 (2) 0.0464 (17) 0.0392 (16) −0.0005 (15) 0.0082 (15) 0.0002 (13)
C41 0.054 (2) 0.0375 (15) 0.0383 (17) 0.0044 (14) 0.0051 (14) 0.0058 (14)
C51 0.0384 (18) 0.0446 (15) 0.0318 (14) −0.0001 (13) 0.0119 (13) 0.0035 (12)
C52 0.0407 (18) 0.0457 (15) 0.0389 (16) 0.0046 (14) 0.0182 (14) 0.0090 (13)
C53 0.056 (2) 0.0463 (17) 0.0477 (18) 0.0001 (15) 0.0179 (16) 0.0005 (14)
C54 0.072 (3) 0.0451 (18) 0.073 (2) −0.0003 (17) 0.031 (2) 0.0008 (17)
C55 0.076 (3) 0.0490 (19) 0.078 (3) 0.0099 (18) 0.032 (2) 0.0204 (19)
C56 0.057 (2) 0.061 (2) 0.058 (2) 0.0113 (18) 0.0199 (17) 0.0262 (18)
C57 0.0436 (19) 0.0540 (18) 0.0409 (16) 0.0052 (15) 0.0177 (14) 0.0119 (14)
C58 0.045 (2) 0.0494 (17) 0.0402 (16) 0.0037 (14) 0.0111 (14) 0.0024 (14)
N1 0.0424 (15) 0.0416 (13) 0.0316 (12) −0.0021 (11) 0.0107 (11) 0.0006 (10)
N2 0.089 (2) 0.0508 (16) 0.0405 (15) 0.0127 (14) 0.0065 (15) −0.0049 (12)
N3 0.0488 (18) 0.0617 (17) 0.0330 (13) 0.0058 (13) 0.0024 (12) 0.0085 (12)
S 0.0982 (9) 0.0602 (5) 0.0497 (5) 0.0089 (5) 0.0167 (5) −0.0073 (4)
Br 0.0616 (3) 0.0661 (3) 0.0687 (3) −0.00767 (17) 0.0314 (2) 0.00167 (16)