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. 2010 Nov 30;66(Pt 12):o3356. doi: 10.1107/S1600536810043709
x y z Uiso*/Ueq Occ. (<1)
O1 0.50718 (15) 0.77955 (19) 0.49310 (6) 0.0560 (5)
C2 0.6021 (2) 0.8610 (3) 0.51636 (10) 0.0490 (6)
C3 0.64762 (19) 0.8378 (2) 0.57594 (9) 0.0440 (6)
C4 0.5962 (2) 0.7392 (2) 0.60580 (9) 0.0456 (6)
C5 0.4958 (2) 0.6556 (3) 0.58143 (10) 0.0483 (6)
C6 0.4409 (2) 0.5503 (3) 0.61028 (12) 0.0588 (7)
H6 0.4684 0.5327 0.6485 0.071*
C7 0.3471 (2) 0.4720 (3) 0.58354 (14) 0.0675 (8)
C8 0.3087 (2) 0.5014 (3) 0.52619 (15) 0.0735 (9)
H8 0.2451 0.4500 0.5075 0.088*
C9 0.3612 (2) 0.6034 (3) 0.49630 (12) 0.0655 (8)
H9 0.3340 0.6203 0.4580 0.079*
C10 0.4550 (2) 0.6802 (3) 0.52418 (10) 0.0512 (6)
O11 0.64195 (16) 0.9454 (2) 0.48534 (7) 0.0649 (5)
C12 0.75139 (19) 0.9241 (3) 0.60261 (9) 0.0442 (6)
H12 0.7380 1.0154 0.5872 0.053*
C13 0.7374 (2) 0.9318 (3) 0.66888 (9) 0.0447 (6)
C14 0.7351 (2) 0.7859 (3) 0.68848 (9) 0.0491 (6)
O15 0.64021 (15) 0.70590 (17) 0.66098 (6) 0.0538 (4)
C16 0.2891 (3) 0.3579 (3) 0.61477 (16) 0.0964 (11)
H16A 0.2461 0.2984 0.5873 0.145* 0.50
H16B 0.2310 0.3938 0.6399 0.145* 0.50
H16C 0.3533 0.3087 0.6370 0.145* 0.50
H16D 0.3075 0.3689 0.6555 0.145* 0.50
H16E 0.3226 0.2735 0.6029 0.145* 0.50
H16F 0.2003 0.3585 0.6058 0.145* 0.50
C17 0.8802 (2) 0.8790 (3) 0.58752 (9) 0.0493 (6)
C18 0.9676 (2) 0.9762 (3) 0.57662 (11) 0.0684 (8)
H18 0.9468 1.0670 0.5789 0.082*
C19 1.0865 (3) 0.9398 (4) 0.56224 (12) 0.0835 (10)
H19 1.1443 1.0064 0.5552 0.100*
C20 1.1177 (3) 0.8095 (5) 0.55848 (13) 0.0848 (11)
H20 1.1971 0.7857 0.5490 0.102*
C21 1.0328 (3) 0.7111 (4) 0.56862 (13) 0.0832 (10)
H21 1.0546 0.6207 0.5658 0.100*
C22 0.9136 (2) 0.7461 (3) 0.58313 (11) 0.0633 (7)
H22 0.8563 0.6787 0.5899 0.076*
C23 0.8437 (2) 1.0061 (3) 0.70278 (10) 0.0583 (7)
H23A 0.8475 1.0973 0.6891 0.087*
H23B 0.9212 0.9613 0.6977 0.087*
H23C 0.8294 1.0067 0.7429 0.087*
N24 0.61573 (15) 0.9977 (2) 0.67699 (7) 0.0444 (5)
C25 0.5853 (2) 1.1225 (3) 0.64515 (11) 0.0613 (7)
H25A 0.6605 1.1728 0.6412 0.092*
H25B 0.5290 1.1756 0.6657 0.092*
H25C 0.5467 1.1007 0.6076 0.092*
C26 0.5548 (2) 0.9634 (3) 0.72315 (10) 0.0490 (6)
O27 0.59794 (16) 0.8770 (2) 0.75754 (7) 0.0659 (5)
C28 0.4305 (2) 1.0259 (3) 0.73030 (10) 0.0502 (6)
C29 0.3308 (2) 1.0086 (3) 0.68954 (12) 0.0716 (8)
H29 0.3414 0.9615 0.6558 0.086*
C30 0.2151 (2) 1.0614 (4) 0.69901 (14) 0.0843 (10)
H30 0.1477 1.0472 0.6719 0.101*
C31 0.1984 (3) 1.1333 (4) 0.74701 (14) 0.0807 (9)
H31 0.1206 1.1700 0.7526 0.097*
C32 0.2965 (3) 1.1516 (4) 0.78720 (13) 0.0806 (9)
H32 0.2856 1.2013 0.8203 0.097*
C33 0.4116 (2) 1.0973 (3) 0.77930 (11) 0.0657 (8)
H33 0.4773 1.1091 0.8075 0.079*
O34 0.81109 (15) 0.7302 (2) 0.72014 (7) 0.0637 (5)
C34 0.5741 (5) 0.8527 (5) 0.8947 (2) 0.1397 (17)
H34A 0.5325 0.7866 0.8698 0.210*
H34B 0.5214 0.9305 0.8969 0.210*
H34C 0.5915 0.8150 0.9325 0.210*
O35 0.6784 (3) 0.8881 (7) 0.87417 (13) 0.208 (2)
H35 0.6675 0.8947 0.8390 0.312*