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. 2015 Apr 22;71(Pt 5):523–527. doi: 10.1107/S2056989015006994
x y z Uiso*/Ueq
P1 0.46337 (9) 0.13395 (7) 0.54974 (7) 0.0247 (2)
O1 0.2783 (3) 0.1230 (4) 0.2325 (3) 0.0450 (7)
O2 0.4313 (3) 0.2739 (3) 0.5441 (3) 0.0352 (6)
C1 0.4309 (5) 0.1015 (3) 0.2672 (3) 0.0328 (8)
C2 0.5430 (4) 0.0741 (4) 0.4198 (3) 0.0286 (7)
H2A 0.6592 0.1108 0.4399 0.034*
H2B 0.5572 −0.0192 0.4317 0.034*
C3 0.5199 (5) 0.0970 (4) 0.1613 (4) 0.0403 (9)
C4 0.3850 (8) 0.0965 (11) 0.0140 (5) 0.105 (4)
H4A 0.3118 0.0210 0.0006 0.157*
H4B 0.4422 0.0952 −0.0536 0.157*
H4C 0.3133 0.1731 −0.0008 0.157*
C5 0.6294 (11) 0.2154 (7) 0.1830 (7) 0.090 (3)
H5A 0.5596 0.2900 0.1842 0.135*
H5B 0.6712 0.2237 0.1062 0.135*
H5C 0.7284 0.2094 0.2726 0.135*
C6 0.6318 (9) −0.0220 (7) 0.1848 (6) 0.0713 (17)
H6A 0.7288 −0.0159 0.2757 0.107*
H6B 0.6765 −0.0295 0.1096 0.107*
H6C 0.5619 −0.0970 0.1842 0.107*
C7 0.6358 (4) 0.0881 (4) 0.7129 (3) 0.0280 (7)
C8 0.7278 (5) 0.1814 (4) 0.8067 (4) 0.0400 (9)
H8 0.6982 0.2684 0.7865 0.048*
C9 0.8634 (5) 0.1477 (6) 0.9304 (4) 0.0518 (12)
H9 0.9264 0.2117 0.9946 0.062*
C10 0.9069 (5) 0.0207 (5) 0.9603 (4) 0.0485 (11)
H10 0.9994 −0.0023 1.0449 0.058*
C11 0.8157 (5) −0.0721 (5) 0.8669 (4) 0.0459 (10)
H11 0.8455 −0.1590 0.8873 0.055*
C12 0.6802 (4) −0.0389 (4) 0.7431 (4) 0.0341 (8)
H12 0.6178 −0.1031 0.6790 0.041*
C13 0.2784 (4) 0.0408 (4) 0.5431 (3) 0.0270 (6)
C14 0.2209 (5) −0.0666 (4) 0.4600 (4) 0.0399 (9)
H14 0.2786 −0.0945 0.4012 0.048*
C15 0.0789 (6) −0.1332 (5) 0.4632 (5) 0.0486 (11)
H15 0.0387 −0.2059 0.4051 0.058*
C16 −0.0046 (5) −0.0952 (5) 0.5495 (5) 0.0462 (10)
H16 −0.1014 −0.1416 0.5513 0.055*
C17 0.0532 (5) 0.0105 (4) 0.6328 (4) 0.0422 (9)
H17 −0.0035 0.0366 0.6930 0.051*
C18 0.1936 (5) 0.0793 (4) 0.6298 (4) 0.0337 (7)
H18 0.2320 0.1528 0.6870 0.040*