| x | y | z | U11 | U22 | U33 | U23 | U13 | U12 |
I1 | −0.9004 (3) | 0.4839 (10) | −0.01368 (19) | 0.078 (2) | 0.137 (4) | 0.118 (3) | 0.008 (2) | 0.0241 (12) | 0.004 (2) |
I1A | −0.90564 (19) | 0.4840 (5) | −0.01653 (11) | 0.0351 (13) | 0.0534 (19) | 0.0427 (18) | 0.0068 (10) | 0.0069 (7) | 0.0078 (10) |
O1 | −0.2276 (3) | 0.3942 (5) | 0.1453 (2) | 0.0478 (18) | 0.097 (3) | 0.0488 (19) | 0.0121 (17) | 0.0062 (16) | −0.0031 (17) |
O2 | 0.0196 (3) | 0.0022 (7) | 0.3744 (2) | 0.0655 (17) | 0.049 (2) | 0.082 (2) | −0.001 (3) | 0.0054 (16) | −0.013 (3) |
O3 | 0.6075 (5) | 0.7777 (7) | 0.7225 (3) | 0.092 (3) | 0.098 (3) | 0.075 (3) | −0.015 (3) | 0.004 (2) | −0.033 (3) |
O4 | −0.2386 (3) | 0.4688 (12) | 0.0086 (2) | 0.0625 (18) | 0.136 (4) | 0.0583 (19) | 0.023 (4) | 0.0176 (16) | 0.013 (4) |
O5 | 0.6222 (8) | 0.3676 (15) | 0.6569 (7) | 0.063 (5) | 0.132 (8) | 0.120 (8) | −0.027 (7) | 0.001 (6) | 0.010 (5) |
C1 | 0.0849 (5) | 0.5963 (7) | 0.2856 (3) | 0.061 (3) | 0.065 (3) | 0.060 (3) | 0.012 (3) | 0.012 (3) | −0.008 (3) |
C2 | −0.0455 (6) | 0.5917 (9) | 0.2102 (4) | 0.071 (4) | 0.070 (4) | 0.056 (4) | 0.014 (3) | 0.007 (3) | −0.001 (3) |
C3 | −0.0835 (5) | 0.4063 (8) | 0.1771 (3) | 0.045 (3) | 0.085 (4) | 0.045 (3) | 0.003 (3) | 0.010 (2) | −0.004 (3) |
C4 | −0.0383 (4) | 0.2663 (8) | 0.2466 (3) | 0.044 (3) | 0.060 (3) | 0.056 (3) | −0.005 (2) | 0.015 (2) | 0.000 (2) |
C5 | 0.0411 (4) | 0.2954 (6) | 0.3296 (3) | 0.035 (2) | 0.052 (3) | 0.048 (3) | 0.000 (2) | 0.016 (2) | 0.0014 (19) |
C6 | 0.0825 (4) | 0.1383 (6) | 0.3883 (3) | 0.045 (2) | 0.047 (3) | 0.057 (3) | −0.005 (2) | 0.018 (2) | 0.001 (2) |
C7 | 0.2091 (4) | 0.1541 (6) | 0.4638 (3) | 0.046 (2) | 0.046 (3) | 0.057 (3) | 0.000 (2) | 0.013 (2) | −0.001 (2) |
C8 | 0.2347 (4) | 0.3358 (6) | 0.5056 (3) | 0.038 (2) | 0.046 (3) | 0.050 (3) | −0.001 (2) | 0.013 (2) | 0.002 (2) |
C9 | 0.2227 (3) | 0.4748 (10) | 0.4349 (2) | 0.0448 (18) | 0.044 (2) | 0.0488 (19) | −0.004 (3) | 0.0147 (16) | −0.008 (3) |
C10 | 0.0841 (3) | 0.4802 (10) | 0.3639 (2) | 0.0436 (18) | 0.046 (2) | 0.0474 (19) | 0.004 (4) | 0.0133 (16) | 0.007 (4) |
C11 | 0.2686 (6) | 0.6606 (7) | 0.4732 (4) | 0.070 (4) | 0.050 (3) | 0.074 (4) | 0.008 (3) | −0.003 (3) | −0.010 (3) |
C12 | 0.4028 (6) | 0.6589 (8) | 0.5450 (4) | 0.058 (3) | 0.056 (3) | 0.064 (3) | −0.001 (3) | 0.002 (3) | −0.012 (3) |
C13 | 0.4064 (4) | 0.5297 (6) | 0.6180 (3) | 0.045 (2) | 0.049 (4) | 0.055 (3) | −0.007 (2) | 0.014 (2) | −0.005 (2) |
C14 | 0.3719 (5) | 0.3461 (7) | 0.5744 (3) | 0.045 (3) | 0.054 (3) | 0.049 (3) | 0.001 (2) | 0.019 (2) | 0.000 (2) |
C15 | 0.4207 (6) | 0.2153 (8) | 0.6506 (4) | 0.069 (3) | 0.077 (4) | 0.069 (4) | 0.011 (3) | 0.002 (3) | −0.003 (3) |
C16 | 0.5413 (6) | 0.3080 (10) | 0.7084 (4) | 0.058 (4) | 0.107 (6) | 0.061 (4) | 0.012 (3) | 0.007 (3) | −0.005 (3) |
C17 | 0.5377 (4) | 0.4865 (14) | 0.6877 (3) | 0.050 (2) | 0.081 (3) | 0.052 (2) | −0.006 (5) | 0.0121 (18) | 0.006 (5) |
C18 | 0.3153 (5) | 0.5886 (9) | 0.6694 (4) | 0.061 (3) | 0.116 (5) | 0.074 (4) | −0.034 (3) | 0.018 (3) | 0.002 (3) |
C19 | −0.0173 (5) | 0.5492 (7) | 0.4041 (3) | 0.054 (3) | 0.059 (3) | 0.069 (3) | −0.005 (2) | 0.013 (2) | 0.010 (2) |
C20 | 0.6320 (6) | 0.6235 (10) | 0.7383 (3) | 0.058 (3) | 0.097 (5) | 0.047 (3) | −0.005 (3) | 0.017 (3) | −0.018 (3) |
C21 | 0.7575 (5) | 0.5635 (10) | 0.8054 (4) | 0.055 (3) | 0.140 (7) | 0.062 (3) | 0.000 (3) | 0.007 (3) | −0.024 (3) |
C22 | −0.2920 (5) | 0.4382 (7) | 0.0610 (3) | 0.060 (3) | 0.065 (5) | 0.050 (3) | 0.015 (2) | 0.012 (2) | 0.004 (2) |
C23 | −0.4351 (4) | 0.4442 (6) | 0.0434 (3) | 0.051 (2) | 0.057 (5) | 0.047 (2) | 0.008 (2) | 0.0078 (19) | 0.001 (2) |
C24 | −0.4870 (5) | 0.4457 (10) | 0.1114 (3) | 0.059 (3) | 0.104 (7) | 0.045 (2) | 0.005 (3) | 0.007 (2) | 0.000 (3) |
C25 | −0.6198 (5) | 0.4574 (11) | 0.0934 (3) | 0.059 (3) | 0.097 (6) | 0.053 (2) | 0.010 (3) | 0.018 (2) | 0.006 (4) |
C26 | −0.7023 (4) | 0.4660 (11) | 0.0076 (3) | 0.055 (2) | 0.054 (3) | 0.059 (2) | 0.007 (3) | 0.011 (2) | 0.003 (3) |
C27 | −0.6519 (5) | 0.4670 (14) | −0.0604 (3) | 0.064 (3) | 0.092 (5) | 0.050 (2) | 0.004 (4) | 0.007 (2) | 0.007 (5) |
C28 | −0.5195 (5) | 0.4571 (11) | −0.0426 (3) | 0.061 (3) | 0.088 (6) | 0.050 (2) | 0.006 (3) | 0.014 (2) | 0.015 (4) |