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. 2009 Jan 10;65(Pt 2):o283–o284. doi: 10.1107/S1600536809000324
U11 U22 U33 U12 U13 U23
O1W 0.039 (3) 0.033 (3) 0.037 (2) 0.018 (2) 0.011 (2) 0.0050 (19)
O2W 0.083 (4) 0.032 (3) 0.046 (3) −0.016 (3) −0.019 (3) 0.008 (2)
O3W 0.059 (3) 0.027 (3) 0.037 (2) 0.000 (2) −0.003 (2) 0.0035 (19)
O4W 0.044 (3) 0.034 (3) 0.061 (3) −0.010 (2) 0.001 (2) 0.008 (2)
O5W 0.034 (3) 0.063 (4) 0.072 (3) 0.003 (2) 0.006 (2) 0.028 (3)
I1 0.0291 (2) 0.0148 (2) 0.03152 (18) 0.00230 (15) 0.01180 (15) 0.00385 (14)
I2 0.0374 (2) 0.0207 (2) 0.03183 (19) −0.00250 (17) 0.01728 (17) 0.00016 (15)
I3 0.02080 (19) 0.0211 (2) 0.01620 (15) 0.00576 (15) 0.00688 (13) 0.00553 (13)
I4 0.02065 (19) 0.0215 (2) 0.02325 (16) 0.00578 (15) 0.00691 (14) 0.00628 (14)
N1 0.021 (2) 0.026 (3) 0.0111 (17) 0.009 (2) 0.0055 (16) 0.0093 (17)
C2 0.016 (3) 0.024 (3) 0.013 (2) 0.005 (2) 0.0072 (19) 0.005 (2)
C3 0.020 (3) 0.016 (3) 0.010 (2) 0.002 (2) 0.0079 (19) 0.0060 (19)
C4 0.015 (3) 0.009 (3) 0.017 (2) −0.001 (2) 0.0066 (19) 0.0013 (19)
C5 0.013 (3) 0.010 (3) 0.020 (2) −0.001 (2) 0.001 (2) −0.0069 (19)
C6 0.020 (3) 0.028 (3) 0.008 (2) 0.001 (2) 0.0085 (19) 0.003 (2)
C7 0.033 (3) 0.043 (4) 0.014 (2) 0.019 (3) 0.008 (2) 0.011 (2)
S8 0.0166 (6) 0.0169 (7) 0.0104 (5) 0.0073 (5) 0.0068 (5) 0.0052 (5)
O9 0.027 (2) 0.030 (2) 0.0143 (15) 0.0194 (17) 0.0100 (14) 0.0111 (14)
O10 0.0186 (19) 0.029 (2) 0.0169 (15) 0.0085 (16) 0.0073 (14) 0.0054 (15)
N11 0.020 (2) 0.016 (2) 0.0162 (18) 0.0019 (19) 0.0064 (17) −0.0004 (17)
C12 0.027 (3) 0.045 (4) 0.019 (2) −0.007 (3) 0.002 (2) 0.000 (2)
C13 0.045 (4) 0.017 (3) 0.032 (3) 0.014 (3) 0.012 (3) 0.007 (2)
N14 0.020 (2) 0.017 (2) 0.0110 (17) 0.0109 (19) 0.0099 (16) 0.0027 (16)
C15 0.017 (3) 0.010 (3) 0.013 (2) 0.004 (2) 0.0037 (19) −0.0021 (18)
C16 0.014 (2) 0.009 (3) 0.0121 (19) 0.003 (2) 0.0003 (18) 0.0009 (18)
C17 0.013 (2) 0.015 (3) 0.013 (2) −0.001 (2) 0.0028 (18) 0.0013 (19)
C18 0.017 (3) 0.013 (3) 0.012 (2) 0.005 (2) 0.0078 (19) −0.0003 (18)
C19 0.018 (3) 0.009 (3) 0.012 (2) 0.006 (2) −0.0009 (19) −0.0010 (18)
C20 0.018 (3) 0.016 (3) 0.0069 (19) 0.003 (2) 0.0046 (18) −0.0002 (18)
O21 0.0182 (18) 0.0119 (19) 0.0200 (15) 0.0068 (15) 0.0084 (14) 0.0044 (14)
C22 0.031 (3) 0.033 (4) 0.033 (3) 0.020 (3) 0.025 (3) 0.013 (2)
C23 0.019 (3) 0.013 (3) 0.013 (2) 0.006 (2) 0.0072 (19) 0.0026 (18)
N24 0.022 (2) 0.009 (2) 0.0134 (17) 0.0030 (18) 0.0061 (16) 0.0032 (16)
C25 0.021 (3) 0.015 (3) 0.015 (2) 0.006 (2) 0.006 (2) −0.0019 (19)
C26 0.026 (3) 0.023 (3) 0.026 (2) 0.010 (2) 0.010 (2) 0.004 (2)
C27 0.017 (3) 0.016 (3) 0.027 (2) 0.004 (2) 0.003 (2) 0.005 (2)
C28 0.027 (3) 0.018 (3) 0.040 (3) 0.001 (3) 0.002 (3) −0.006 (2)
C29 0.027 (3) 0.012 (3) 0.020 (2) 0.005 (2) 0.005 (2) 0.004 (2)
N41 0.015 (2) 0.018 (2) 0.0118 (17) 0.0056 (18) 0.0040 (16) 0.0040 (16)
C42 0.018 (3) 0.019 (3) 0.011 (2) 0.006 (2) 0.0092 (19) 0.0050 (19)
C43 0.011 (2) 0.013 (3) 0.019 (2) 0.003 (2) 0.0057 (19) 0.0019 (19)
C44 0.016 (3) 0.008 (2) 0.013 (2) 0.003 (2) 0.0039 (19) 0.0030 (18)
C45 0.017 (3) 0.010 (3) 0.0083 (19) 0.003 (2) 0.0049 (18) 0.0022 (17)
C46 0.012 (2) 0.013 (3) 0.019 (2) 0.005 (2) 0.0088 (19) 0.0037 (19)
C47 0.024 (3) 0.034 (3) 0.016 (2) 0.014 (3) 0.008 (2) 0.012 (2)
S48 0.0197 (7) 0.0166 (7) 0.0100 (5) 0.0068 (5) 0.0079 (5) 0.0029 (5)
O49 0.024 (2) 0.017 (2) 0.0133 (14) 0.0087 (16) 0.0059 (14) 0.0050 (14)
O50 0.0163 (19) 0.024 (2) 0.0172 (15) 0.0073 (16) 0.0084 (14) 0.0061 (14)
N51 0.025 (2) 0.016 (2) 0.0178 (19) 0.0041 (19) 0.0074 (18) 0.0003 (17)
C52 0.038 (3) 0.014 (3) 0.029 (3) 0.005 (3) 0.013 (2) 0.003 (2)
C53 0.026 (3) 0.025 (3) 0.026 (3) −0.002 (3) 0.004 (2) 0.000 (2)
N54 0.014 (2) 0.021 (2) 0.0113 (17) 0.0080 (18) 0.0051 (16) 0.0044 (16)
C55 0.012 (2) 0.020 (3) 0.011 (2) 0.007 (2) 0.0008 (18) −0.0023 (19)
C56 0.019 (3) 0.010 (3) 0.012 (2) 0.006 (2) 0.0043 (19) 0.0023 (18)
C57 0.018 (3) 0.016 (3) 0.012 (2) 0.001 (2) 0.0027 (19) 0.0011 (19)
C58 0.014 (3) 0.015 (3) 0.0090 (19) 0.007 (2) 0.0026 (18) 0.0024 (18)
C59 0.017 (3) 0.009 (3) 0.0084 (19) 0.003 (2) −0.0013 (18) −0.0018 (17)
C60 0.018 (3) 0.015 (3) 0.014 (2) 0.006 (2) 0.0068 (19) 0.0022 (19)
O61 0.0165 (18) 0.023 (2) 0.0173 (15) 0.0080 (16) 0.0107 (14) 0.0070 (14)
C62 0.039 (4) 0.050 (4) 0.045 (3) 0.030 (3) 0.033 (3) 0.032 (3)
C63 0.017 (3) 0.014 (3) 0.015 (2) 0.002 (2) 0.0048 (19) 0.0026 (19)
N64 0.023 (2) 0.013 (2) 0.0151 (18) 0.0059 (19) 0.0065 (17) 0.0036 (16)
C65 0.022 (3) 0.018 (3) 0.018 (2) 0.007 (2) 0.009 (2) 0.006 (2)
C66 0.029 (3) 0.020 (3) 0.020 (2) 0.005 (2) 0.010 (2) 0.004 (2)
C67 0.018 (3) 0.018 (3) 0.022 (2) 0.001 (2) 0.006 (2) 0.002 (2)
C68 0.033 (3) 0.024 (3) 0.036 (3) 0.001 (3) 0.021 (3) 0.006 (2)
C69 0.039 (3) 0.012 (3) 0.025 (2) 0.010 (3) 0.005 (2) 0.007 (2)