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. 2008 Nov 13;64(Pt 12):o2356. doi: 10.1107/S1600536808037240
x y z Uiso*/Ueq
C3 −0.0408 (3) 0.00360 (19) 0.37884 (14) 0.0446 (5)
C4 0.1214 (3) 0.00403 (18) 0.44674 (14) 0.0425 (5)
C5 0.1708 (3) −0.10707 (19) 0.45566 (14) 0.0431 (5)
C7 0.4230 (3) −0.07508 (19) 0.56234 (16) 0.0500 (6)
H7 0.5254 −0.0987 0.6016 0.06*
C8 0.3874 (3) 0.03680 (18) 0.55955 (14) 0.0452 (5)
C9 0.4917 (3) 0.13014 (18) 0.61003 (15) 0.0455 (5)
C11 0.2390 (3) 0.19832 (18) 0.51522 (14) 0.0442 (5)
C12 0.2381 (3) 0.07694 (18) 0.50241 (14) 0.0427 (5)
C13 0.0263 (3) −0.28159 (19) 0.37880 (16) 0.0462 (5)
C14 0.0917 (3) −0.3569 (2) 0.44682 (16) 0.0514 (6)
H14 0.1508 −0.3332 0.5049 0.062*
C15 0.0681 (3) −0.4684 (2) 0.42733 (19) 0.0584 (7)
H15 0.1132 −0.5198 0.4726 0.07*
C16 −0.0219 (3) −0.5039 (2) 0.3414 (2) 0.0606 (7)
H16 −0.0394 −0.5787 0.3289 0.073*
C17 −0.0852 (3) −0.4279 (2) 0.27450 (19) 0.0616 (7)
H17 −0.1454 −0.4516 0.2165 0.074*
C18 −0.0604 (3) −0.3157 (2) 0.29235 (16) 0.0542 (6)
H18 −0.1016 −0.2645 0.2468 0.065*
C19 −0.1519 (3) 0.0984 (2) 0.34157 (17) 0.0549 (6)
H19A −0.2592 0.0727 0.3172 0.082*
H19B −0.1383 0.1329 0.2962 0.082*
H19C −0.13 0.1509 0.3874 0.082*
C21 0.4456 (3) 0.33472 (18) 0.60655 (14) 0.0426 (5)
C22 0.3722 (3) 0.3988 (2) 0.64181 (16) 0.0489 (5)
H22 0.2948 0.3685 0.6523 0.059*
C23 0.4150 (3) 0.5083 (2) 0.66135 (16) 0.0507 (6)
H23 0.3682 0.5525 0.6859 0.061*
C24 0.5284 (3) 0.55016 (18) 0.64357 (14) 0.0461 (5)
C25 0.6055 (3) 0.4867 (2) 0.61069 (15) 0.0496 (6)
H25 0.6842 0.5169 0.6012 0.06*
C26 0.5631 (3) 0.37726 (19) 0.59215 (15) 0.0480 (5)
H26 0.6134 0.3325 0.5701 0.058*
O20 0.6301 (2) 0.12980 (14) 0.66441 (12) 0.0587 (5)
O27 0.1327 (2) 0.26369 (14) 0.47771 (13) 0.0592 (5)
O30 0.6424 (2) 0.70822 (16) 0.62526 (14) 0.0675 (6)
N1 0.0428 (2) −0.16562 (16) 0.39668 (12) 0.0469 (5)
N2 −0.0858 (2) −0.09733 (17) 0.34974 (13) 0.0497 (5)
N6 0.3155 (2) −0.14946 (16) 0.51075 (13) 0.0489 (5)
N10 0.3932 (2) 0.22413 (15) 0.58107 (12) 0.0453 (5)
N28 0.5686 (3) 0.66741 (18) 0.65876 (13) 0.0561 (6)
O29 0.5258 (3) 0.71978 (17) 0.70287 (16) 0.0830 (7)