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. 2017 Nov 7;73(Pt 12):1835–1839. doi: 10.1107/S2056989017015985
U11 U22 U33 U12 U13 U23
N11 0.0449 (19) 0.061 (2) 0.0451 (19) −0.0023 (18) −0.0030 (15) 0.0026 (18)
C111 0.038 (2) 0.052 (3) 0.050 (2) −0.003 (2) 0.0001 (16) 0.0036 (19)
C112 0.051 (3) 0.048 (2) 0.044 (2) 0.001 (2) −0.0012 (17) 0.0011 (18)
C113 0.046 (2) 0.046 (2) 0.054 (2) −0.0002 (19) 0.0016 (18) 0.004 (2)
C114 0.062 (3) 0.054 (3) 0.067 (3) 0.008 (2) 0.003 (2) −0.008 (2)
C115 0.071 (3) 0.072 (3) 0.059 (3) 0.002 (3) 0.002 (2) −0.024 (2)
C116 0.060 (3) 0.075 (3) 0.049 (2) −0.007 (3) −0.005 (2) −0.007 (2)
C117 0.050 (2) 0.051 (3) 0.060 (3) 0.006 (2) 0.001 (2) 0.005 (2)
O117 0.090 (2) 0.069 (2) 0.063 (2) 0.0239 (19) −0.0219 (17) −0.0097 (19)
C118 0.077 (3) 0.075 (4) 0.074 (3) 0.024 (3) −0.004 (3) 0.004 (3)
C127 0.045 (2) 0.056 (3) 0.047 (2) −0.004 (2) −0.0084 (18) 0.005 (2)
C121 0.043 (2) 0.048 (2) 0.045 (2) −0.008 (2) −0.0013 (17) 0.006 (2)
C122 0.045 (2) 0.053 (2) 0.040 (2) −0.006 (2) 0.0003 (16) 0.0062 (18)
C123 0.043 (2) 0.065 (3) 0.047 (2) −0.003 (2) −0.0026 (18) 0.011 (2)
C124 0.049 (2) 0.062 (3) 0.062 (3) 0.004 (2) 0.004 (2) 0.010 (2)
C125 0.059 (3) 0.057 (3) 0.059 (3) −0.004 (2) 0.001 (2) −0.002 (2)
C126 0.052 (2) 0.062 (3) 0.053 (3) −0.008 (2) −0.007 (2) −0.001 (2)
O122 0.0591 (18) 0.075 (2) 0.0451 (16) 0.0062 (16) −0.0082 (14) −0.0004 (15)
O123 0.069 (2) 0.097 (3) 0.0564 (19) 0.024 (2) −0.0184 (17) 0.0036 (18)
C128 0.065 (3) 0.089 (4) 0.077 (4) 0.016 (3) −0.018 (3) 0.014 (3)
N21 0.0439 (19) 0.062 (2) 0.050 (2) −0.0086 (18) −0.0011 (15) −0.0127 (18)
C211 0.042 (2) 0.053 (3) 0.048 (2) 0.003 (2) −0.0002 (17) −0.0074 (19)
C212 0.041 (2) 0.058 (3) 0.046 (2) −0.001 (2) 0.0011 (17) −0.0033 (19)
C213 0.044 (2) 0.053 (2) 0.048 (2) 0.003 (2) −0.0008 (17) −0.0063 (19)
C214 0.053 (3) 0.055 (3) 0.065 (3) −0.006 (2) 0.001 (2) 0.001 (2)
C215 0.065 (3) 0.063 (3) 0.063 (3) −0.002 (3) −0.004 (2) 0.010 (2)
C216 0.054 (3) 0.069 (3) 0.054 (3) 0.000 (2) −0.009 (2) −0.002 (2)
C217 0.052 (2) 0.055 (3) 0.054 (3) −0.007 (2) −0.003 (2) −0.012 (2)
O217 0.088 (3) 0.078 (2) 0.064 (2) −0.023 (2) −0.0262 (18) 0.005 (2)
C218 0.082 (4) 0.078 (3) 0.067 (3) −0.031 (3) −0.010 (3) −0.011 (3)
C227 0.038 (2) 0.059 (3) 0.051 (3) 0.006 (2) −0.0052 (18) −0.008 (2)
C221 0.039 (2) 0.058 (3) 0.047 (2) 0.002 (2) 0.0019 (17) −0.010 (2)
C222 0.047 (2) 0.073 (3) 0.043 (2) −0.015 (2) 0.0048 (17) −0.007 (2)
C223 0.055 (3) 0.089 (4) 0.044 (2) −0.021 (3) 0.005 (2) −0.015 (2)
C224 0.060 (3) 0.067 (3) 0.061 (3) −0.016 (2) 0.012 (2) −0.010 (2)
C225 0.061 (3) 0.058 (3) 0.061 (3) −0.001 (2) 0.005 (2) 0.004 (2)
C226 0.052 (2) 0.059 (3) 0.054 (2) 0.007 (2) −0.007 (2) −0.001 (2)
O222 0.079 (2) 0.117 (3) 0.0437 (17) −0.045 (2) −0.0040 (16) 0.004 (2)
O223 0.093 (3) 0.143 (4) 0.0508 (18) −0.067 (3) −0.0126 (18) 0.000 (2)
C228 0.097 (4) 0.151 (6) 0.078 (4) −0.070 (4) −0.010 (3) −0.022 (4)