x	y	z	Uiso*/Ueq
S7	0.71907 (8)	0.43498 (5)	0.42513 (4)	0.0376 (2)
S37	0.27962 (8)	0.47770 (4)	0.44305 (4)	0.0324 (2)
O3	0.2810 (2)	0.85941 (11)	0.69965 (12)	0.0340 (5)
O4	0.4194 (2)	0.77876 (12)	0.69694 (13)	0.0380 (6)
O5	0.2773 (2)	0.64259 (12)	0.29296 (13)	0.0395 (6)
O1	0.3156 (3)	0.56393 (12)	0.65973 (14)	0.0458 (7)
O2	0.4351 (2)	0.65270 (12)	0.67442 (14)	0.0397 (6)
H2O	0.4307	0.6961	0.6812	0.048*
O22	0.3315 (2)	0.23474 (12)	0.42581 (12)	0.0367 (6)
O7	0.3143 (3)	0.93613 (13)	0.33972 (16)	0.0521 (8)
O6	0.4133 (2)	0.72465 (13)	0.28657 (14)	0.0428 (6)
N48	0.0515 (2)	0.44623 (13)	0.75804 (13)	0.0267 (6)
H48N	0.1129	0.4098	0.7628	0.032*
N18	0.5491 (2)	0.45179 (13)	0.77062 (12)	0.0261 (6)
H18N	0.6141	0.4180	0.7763	0.031*
O8	0.4289 (2)	0.85049 (13)	0.30770 (15)	0.0441 (6)
H8O	0.4253	0.8067	0.3030	0.053*
N10	0.5392 (2)	0.43086 (14)	0.52619 (13)	0.0274 (6)
C16	0.5607 (3)	0.44213 (16)	0.64667 (14)	0.0256 (6)
H16	0.5808	0.4929	0.6417	0.031*
C20	0.4693 (3)	0.4429 (2)	0.82668 (16)	0.0351 (8)
H20A	0.4062	0.4767	0.8230	0.053*
H20B	0.5110	0.4509	0.8675	0.053*
H20C	0.4380	0.3951	0.8264	0.053*
C27	0.3141 (3)	0.79688 (17)	0.69359 (16)	0.0304 (7)
C17	0.4879 (3)	0.43375 (17)	0.70818 (14)	0.0269 (6)
H17A	0.4192	0.4641	0.7042	0.032*
H17B	0.4611	0.3845	0.7108	0.032*
N40	0.0636 (3)	0.45554 (14)	0.51572 (13)	0.0327 (6)
C36	0.1707 (3)	0.41769 (16)	0.42030 (15)	0.0288 (7)
C46	0.0698 (3)	0.44388 (16)	0.63495 (15)	0.0291 (7)
H46	0.1011	0.4928	0.6358	0.035*
C45	−0.0030 (3)	0.43515 (18)	0.57258 (16)	0.0331 (7)
H45A	−0.0276	0.3856	0.5682	0.040*
H45B	−0.0727	0.4647	0.5756	0.040*
C47	−0.0078 (3)	0.43418 (17)	0.69381 (16)	0.0290 (7)
H47A	−0.0733	0.4671	0.6902	0.035*
H47B	−0.0391	0.3859	0.6932	0.035*
C50	−0.0309 (3)	0.4373 (2)	0.81310 (17)	0.0358 (8)
H50A	0.0107	0.4396	0.8546	0.054*
H50B	−0.0691	0.3917	0.8093	0.054*
H50C	−0.0885	0.4748	0.8116	0.054*
C14	0.5155 (3)	0.55931 (18)	0.53450 (17)	0.0339 (7)
H14	0.4561	0.5537	0.5659	0.041*
C21	0.6714 (3)	0.39977 (18)	0.64729 (17)	0.0327 (7)
H21A	0.7201	0.4156	0.6834	0.049*
H21B	0.7121	0.4065	0.6059	0.049*
H21C	0.6532	0.3499	0.6529	0.049*
O52	−0.0838 (3)	0.27161 (18)	0.38223 (15)	0.0592 (9)
C15	0.4825 (3)	0.42064 (17)	0.58918 (14)	0.0270 (7)
H15A	0.4609	0.3706	0.5939	0.032*
H15B	0.4112	0.4489	0.5905	0.032*
C1	0.5213 (3)	0.38102 (15)	0.47535 (15)	0.0264 (6)
C9	0.5686 (3)	0.50069 (17)	0.50747 (15)	0.0299 (7)
C24	0.3317 (3)	0.62659 (17)	0.66822 (18)	0.0341 (8)
C54	0.3118 (3)	0.70422 (17)	0.30093 (18)	0.0347 (8)
C33	0.0037 (3)	0.31867 (17)	0.39121 (17)	0.0332 (7)
C19	0.5978 (3)	0.52445 (17)	0.76919 (17)	0.0339 (8)
H19A	0.5370	0.5580	0.7580	0.051*
H19B	0.6589	0.5269	0.7364	0.051*
H19C	0.6293	0.5361	0.8122	0.051*
C3	0.4162 (3)	0.28458 (16)	0.42653 (17)	0.0319 (7)
C26	0.2222 (3)	0.74344 (17)	0.68253 (19)	0.0366 (8)
H26	0.1462	0.7617	0.6829	0.044*
C6	0.5962 (3)	0.38091 (17)	0.42268 (17)	0.0313 (7)
C55	0.2258 (4)	0.75469 (18)	0.32921 (19)	0.0401 (8)
H55	0.1546	0.7342	0.3416	0.048*
C57	0.3310 (3)	0.87372 (18)	0.32830 (18)	0.0358 (8)
C39	0.0910 (3)	0.52782 (18)	0.50652 (17)	0.0362 (8)
C31	0.0745 (3)	0.41109 (16)	0.46133 (15)	0.0283 (7)
C8	0.6538 (3)	0.51034 (18)	0.46007 (16)	0.0325 (7)
C4	0.4893 (4)	0.28620 (18)	0.37300 (18)	0.0378 (8)
H4	0.4784	0.2541	0.3380	0.045*
C34	0.0976 (3)	0.32530 (18)	0.35056 (17)	0.0345 (8)
H34	0.1053	0.2961	0.3132	0.041*
C5	0.5772 (3)	0.33408 (18)	0.37057 (17)	0.0360 (8)
H5	0.6259	0.3357	0.3334	0.043*
C38	0.1890 (3)	0.54566 (17)	0.47043 (16)	0.0348 (8)
C13	0.5500 (4)	0.62664 (18)	0.51517 (19)	0.0444 (10)
H13	0.5144	0.6667	0.5340	0.053*
C2	0.4303 (3)	0.33317 (16)	0.47697 (16)	0.0294 (7)
H2	0.3779	0.3337	0.5125	0.035*
C25	0.2291 (3)	0.67395 (17)	0.67218 (18)	0.0360 (8)
H25	0.1572	0.6511	0.6664	0.043*
C51	0.1706 (3)	0.3927 (2)	0.63410 (19)	0.0381 (8)
H51A	0.2198	0.4014	0.6720	0.057*
H51B	0.2151	0.3994	0.5940	0.057*
H51C	0.1415	0.3445	0.6357	0.057*
C56	0.2338 (3)	0.82429 (18)	0.33969 (19)	0.0391 (8)
H56	0.1666	0.8453	0.3572	0.047*
C32	−0.0088 (3)	0.36124 (17)	0.44602 (17)	0.0327 (7)
H32	−0.0746	0.3563	0.4731	0.039*
C23	0.2465 (3)	0.23796 (17)	0.47604 (18)	0.0347 (8)
H23A	0.2832	0.2313	0.5186	0.052*
H23B	0.1894	0.2009	0.4690	0.052*
H23C	0.2085	0.2839	0.4749	0.052*
C49	0.1073 (3)	0.51674 (18)	0.76233 (18)	0.0363 (8)
H49A	0.0502	0.5533	0.7534	0.054*
H49B	0.1694	0.5197	0.7302	0.054*
H49C	0.1388	0.5234	0.8062	0.054*
C35	0.1809 (3)	0.37539 (17)	0.36501 (16)	0.0323 (7)
H35	0.2453	0.3808	0.3370	0.039*
C12	0.6355 (4)	0.6354 (2)	0.46897 (19)	0.0477 (10)
H12	0.6589	0.6812	0.4564	0.057*
C11	0.6869 (4)	0.5769 (2)	0.44106 (18)	0.0433 (9)
H11	0.7448	0.5827	0.4089	0.052*
C42	0.1473 (6)	0.6686 (2)	0.4844 (2)	0.0651 (15)
H42	0.1664	0.7163	0.4767	0.078*
C43	0.0522 (5)	0.6517 (2)	0.5214 (2)	0.0640 (14)
H43	0.0068	0.6880	0.5399	0.077*
C44	0.0220 (4)	0.5815 (2)	0.5320 (2)	0.0522 (11)
H44	−0.0450	0.5703	0.5564	0.063*
C41	0.2149 (5)	0.61537 (18)	0.45858 (19)	0.0482 (10)
H41	0.2796	0.6270	0.4325	0.058*
C53	−0.1196 (4)	0.2632 (2)	0.3167 (2)	0.0514 (10)
H53A	−0.1352	0.3093	0.2975	0.077*
H53B	−0.1896	0.2346	0.3154	0.077*
H53C	−0.0588	0.2397	0.2918	0.077*