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. 2012 Feb 10;68(Pt 3):o648. doi: 10.1107/S1600536812004643
x y z Uiso*/Ueq
P1 0.63459 (3) 0.16154 (3) 0.07287 (3) 0.01280 (8)
Se1 0.589654 (11) 0.097347 (10) 0.218666 (12) 0.01702 (5)
C1 0.53424 (10) 0.24106 (10) −0.01384 (12) 0.0147 (3)
H1 0.564 0.2718 −0.0762 0.018*
C2 0.43736 (11) 0.18232 (11) −0.07302 (13) 0.0193 (3)
H2A 0.4569 0.1344 −0.1272 0.023*
H2B 0.4107 0.1458 −0.0132 0.023*
C3 0.35114 (11) 0.24925 (11) −0.14041 (14) 0.0228 (3)
H3A 0.375 0.2799 −0.206 0.027*
H3B 0.2881 0.2099 −0.1733 0.027*
C4 0.32313 (12) 0.32877 (12) −0.06224 (15) 0.0239 (3)
H4A 0.2693 0.3722 −0.1089 0.029*
H4B 0.2936 0.2985 −0.0005 0.029*
C5 0.41921 (12) 0.38870 (11) −0.00652 (14) 0.0222 (3)
H5A 0.3998 0.4382 0.046 0.027*
H5B 0.4452 0.4234 −0.068 0.027*
C6 0.50595 (11) 0.32336 (11) 0.06286 (13) 0.0193 (3)
H6A 0.4826 0.2944 0.1296 0.023*
H6B 0.5688 0.3634 0.0942 0.023*
C7 0.66780 (10) 0.06797 (10) −0.02535 (12) 0.0139 (3)
H7 0.6056 0.0244 −0.0499 0.017*
C8 0.69309 (11) 0.11074 (10) −0.13626 (13) 0.0174 (3)
H8A 0.6317 0.1473 −0.1804 0.021*
H8B 0.7523 0.157 −0.1145 0.021*
C9 0.72156 (12) 0.02992 (11) −0.21352 (13) 0.0198 (3)
H9A 0.6606 −0.0136 −0.24 0.024*
H9B 0.7393 0.0594 −0.2833 0.024*
C10 0.81410 (12) −0.02969 (11) −0.14730 (13) 0.0205 (3)
H10A 0.8764 0.0128 −0.1253 0.025*
H10B 0.8301 −0.0824 −0.1981 0.025*
C11 0.78950 (12) −0.07406 (11) −0.03796 (13) 0.0206 (3)
H11A 0.8515 −0.11 0.0058 0.025*
H11B 0.7313 −0.1213 −0.0606 0.025*
C12 0.75906 (11) 0.00468 (10) 0.04060 (12) 0.0173 (3)
H12A 0.8203 0.0469 0.0712 0.021*
H12B 0.7388 −0.0269 0.1078 0.021*
C13 0.75153 (10) 0.23630 (10) 0.11383 (12) 0.0137 (3)
C14 0.77795 (11) 0.30400 (10) 0.03631 (12) 0.0159 (3)
H14 0.7302 0.3173 −0.0356 0.019*
C15 0.87363 (11) 0.35183 (10) 0.06399 (13) 0.0171 (3)
H15 0.8906 0.3976 0.0106 0.021*
C16 0.94567 (10) 0.33377 (10) 0.16937 (12) 0.0160 (3)
C17 0.91711 (11) 0.26870 (10) 0.24719 (13) 0.0167 (3)
H17 0.9639 0.2567 0.3201 0.02*
C18 0.82115 (11) 0.22069 (10) 0.22028 (12) 0.0150 (3)
H18 0.8031 0.1769 0.2751 0.018*
C19 1.05187 (11) 0.38265 (11) 0.19607 (13) 0.0193 (3)
H19 1.0879 0.3646 0.2775 0.023*
C20 1.11914 (12) 0.34511 (13) 0.11461 (15) 0.0278 (4)
H20A 1.1266 0.2741 0.1225 0.042*
H20B 1.1884 0.3757 0.1354 0.042*
H20C 1.0855 0.3616 0.0339 0.042*
C21 1.04331 (12) 0.49378 (11) 0.19028 (14) 0.0241 (3)
H21A 1.0042 0.5134 0.1126 0.036*
H21B 1.1135 0.5223 0.2055 0.036*
H21C 1.0068 0.5169 0.249 0.036*