x	y	z	Uiso*/Ueq
N1	0.55546 (13)	0.19576 (13)	0.30195 (10)	0.0231 (3)
C2	0.46867 (17)	0.29324 (17)	0.32893 (12)	0.0268 (3)
H2A	0.5193	0.3775	0.3954	0.032*
H2B	0.3853	0.2536	0.3460	0.032*
C3	0.42744 (17)	0.32788 (16)	0.23213 (12)	0.0258 (3)
H3A	0.5117	0.3735	0.2200	0.031*
H3B	0.3865	0.2416	0.1646	0.031*
N4	0.33030 (13)	0.41522 (13)	0.24463 (11)	0.0258 (3)
C10	0.69979 (16)	0.26500 (17)	0.31867 (13)	0.0280 (3)
H10A	0.7441	0.3071	0.3987	0.034*
H10B	0.7017	0.3390	0.2948	0.034*
C11	0.78117 (16)	0.17145 (16)	0.25636 (13)	0.0263 (3)
C12	0.74930 (16)	0.11211 (18)	0.14067 (13)	0.0288 (3)
C13	0.82640 (18)	0.02915 (19)	0.08148 (15)	0.0350 (4)
H13	0.8023	−0.0122	0.0028	0.042*
C14	0.93856 (18)	0.0067 (2)	0.13728 (16)	0.0368 (4)
H14	0.9915	−0.0497	0.0967	0.044*
C15	0.97344 (18)	0.06622 (19)	0.25181 (16)	0.0350 (4)
H15	1.0507	0.0515	0.2901	0.042*
C16	0.89474 (17)	0.14765 (18)	0.31045 (14)	0.0312 (4)
H16	0.9188	0.1880	0.3891	0.037*
C20	0.54425 (17)	0.11170 (17)	0.36403 (13)	0.0268 (3)
H20A	0.5551	0.1718	0.4434	0.032*
H20B	0.6192	0.0640	0.3576	0.032*
C21	0.40800 (16)	0.00815 (16)	0.32108 (13)	0.0259 (3)
C22	0.34574 (17)	−0.05756 (17)	0.20764 (14)	0.0296 (3)
C23	0.22507 (19)	−0.15869 (19)	0.16750 (17)	0.0394 (4)
H23	0.1832	−0.2018	0.0905	0.047*
C24	0.1654 (2)	−0.1970 (2)	0.23937 (19)	0.0457 (5)
H24	0.0838	−0.2678	0.2113	0.055*
C25	0.2237 (2)	−0.1331 (2)	0.35144 (19)	0.0439 (5)
H25	0.1822	−0.1592	0.4007	0.053*
C26	0.34370 (18)	−0.03025 (19)	0.39182 (16)	0.0338 (4)
H26	0.3827	0.0149	0.4693	0.041*
C30	0.20423 (18)	0.36075 (19)	0.27170 (17)	0.0364 (4)
H30A	0.2235	0.3827	0.3516	0.044*
H30B	0.1767	0.2604	0.2293	0.044*
C31	0.08900 (18)	0.41958 (19)	0.24471 (18)	0.0404 (4)
C32	0.0497 (2)	0.4116 (2)	0.13898 (18)	0.0453 (5)
C33	−0.0650 (2)	0.4543 (2)	0.1098 (2)	0.0613 (7)
H33	−0.0926	0.4460	0.0368	0.074*
C34	−0.1378 (2)	0.5087 (2)	0.1875 (3)	0.0637 (7)
H34	−0.2174	0.5359	0.1672	0.076*
C35	−0.0980 (2)	0.5243 (2)	0.2931 (3)	0.0603 (7)
H35	−0.1472	0.5660	0.3467	0.072*
C36	0.0148 (2)	0.4792 (2)	0.3227 (2)	0.0499 (5)
H36	0.0416	0.4889	0.3962	0.060*
C40	0.39032 (17)	0.55858 (16)	0.32520 (14)	0.0286 (3)
H40A	0.4334	0.5613	0.3967	0.034*
H40B	0.3159	0.6066	0.3376	0.034*
C41	0.49612 (16)	0.63311 (16)	0.28855 (13)	0.0247 (3)
C42	0.62638 (16)	0.70468 (16)	0.35788 (12)	0.0260 (3)
C43	0.71949 (16)	0.78163 (17)	0.32493 (13)	0.0284 (3)
C44	0.68364 (17)	0.78221 (17)	0.22159 (13)	0.0293 (3)
H44	0.7473	0.8341	0.1998	0.035*
C45	0.55741 (18)	0.70888 (17)	0.15050 (13)	0.0290 (3)
C46	0.46489 (17)	0.63763 (17)	0.18737 (13)	0.0277 (3)
H46	0.3762	0.5900	0.1406	0.033*
C47	0.85585 (19)	0.8554 (2)	0.39565 (15)	0.0385 (4)
H47	0.9159	0.9059	0.3704	0.046*
C48	0.5214 (2)	0.7027 (2)	0.03654 (14)	0.0406 (4)
H48A	0.5719	0.7864	0.0368	0.061*
H48B	0.4226	0.6935	0.0152	0.061*
H48C	0.5462	0.6241	−0.0166	0.061*
O10	0.64008 (13)	0.13999 (14)	0.09024 (10)	0.0368 (3)
H10	0.6275	0.1024	0.0139	0.044*
O20	0.40399 (13)	−0.02278 (13)	0.13465 (9)	0.0364 (3)
H20	0.4684	0.0616	0.1734	0.044*
O30	0.12438 (17)	0.36127 (17)	0.06209 (13)	0.0586 (4)
H30	0.2124	0.3804	0.1050	0.070*
O40	0.66072 (13)	0.69757 (14)	0.45562 (10)	0.0380 (3)
H40	0.7520	0.7475	0.4859	0.046*
O41	0.89821 (14)	0.85675 (16)	0.48535 (11)	0.0491 (4)