x	y	z	Uiso*/Ueq
N1	0.25627 (8)	0.71181 (9)	0.31343 (7)	0.0246 (3)
H71	0.30128	0.669474	0.349979	0.035 (4)*
N2	0.10023 (8)	0.56683 (9)	0.26575 (7)	0.0233 (3)
C1	0.29865 (11)	0.95151 (12)	0.41661 (10)	0.0334 (5)
H1a	0.245898	0.980932	0.377422	0.0401*
C2	0.33463 (11)	0.86695 (12)	0.39170 (10)	0.0322 (5)
H2	0.386765	0.835478	0.430202	0.0386*
C3	0.29839 (12)	0.81754 (12)	0.30656 (10)	0.0333 (5)
H3a	0.350521	0.811391	0.27725	0.04*
H3b	0.250048	0.862741	0.270514	0.04*
C4	0.17112 (10)	0.71678 (11)	0.34935 (9)	0.0281 (4)
H4a	0.123241	0.762704	0.313566	0.0337*
H4b	0.189039	0.745897	0.40767	0.0337*
C5	0.12943 (10)	0.61031 (11)	0.35226 (9)	0.0271 (4)
H5a	0.07387	0.614805	0.377337	0.0326*
H5b	0.177161	0.564522	0.388386	0.0326*
C6	0.18571 (10)	0.55563 (11)	0.23345 (9)	0.0262 (4)
H6a	0.231171	0.509606	0.271816	0.0315*
H6b	0.168931	0.5233	0.176272	0.0315*
C7	0.23149 (10)	0.65944 (12)	0.22789 (9)	0.0282 (4)
H7a	0.289537	0.649813	0.207068	0.0338*
H7b	0.187639	0.703827	0.186493	0.0338*
C8	0.05326 (9)	0.46528 (10)	0.26756 (8)	0.0230 (4)
H8	0.099282	0.417266	0.304542	0.0276*
C11	0.33145 (11)	1.00535 (12)	0.49876 (10)	0.0326 (5)
C12	0.41578 (13)	0.97941 (14)	0.55685 (10)	0.0391 (5)
H12	0.454927	0.926517	0.543205	0.047*
C13	0.44278 (15)	1.03053 (17)	0.63457 (11)	0.0502 (6)
H13	0.499799	1.011658	0.674094	0.0603*
C14	0.38752 (17)	1.10810 (17)	0.65451 (12)	0.0554 (7)
H14	0.40688	1.143158	0.707495	0.0665*
C15	0.30389 (15)	1.13552 (16)	0.59798 (13)	0.0516 (7)
H15	0.265849	1.18931	0.61197	0.0619*
C16	0.27570 (13)	1.08400 (13)	0.52053 (11)	0.0397 (5)
H16	0.217882	1.102436	0.481949	0.0476*
C21	−0.03166 (9)	0.47504 (10)	0.30647 (8)	0.0240 (4)
C22	−0.04272 (11)	0.40385 (12)	0.36763 (10)	0.0315 (5)
H22	0.003276	0.351198	0.385315	0.0378*
C23	−0.12077 (12)	0.40899 (13)	0.40333 (11)	0.0388 (5)
H23	−0.127745	0.359826	0.445056	0.0466*
C24	−0.18805 (12)	0.48544 (13)	0.37818 (11)	0.0385 (5)
H24	−0.241677	0.488365	0.401911	0.0461*
C25	−0.17687 (11)	0.55719 (12)	0.31859 (11)	0.0351 (5)
H25	−0.222711	0.610174	0.301738	0.0421*
C26	−0.09910 (10)	0.55304 (11)	0.28271 (9)	0.0286 (4)
H26	−0.091899	0.603396	0.241958	0.0344*
C31	0.02520 (10)	0.41880 (11)	0.17810 (9)	0.0248 (4)
C32	0.06690 (11)	0.32720 (12)	0.16027 (10)	0.0331 (5)
H32	0.112496	0.2938	0.204043	0.0397*
C33	0.04254 (13)	0.28416 (13)	0.07918 (11)	0.0392 (5)
H33	0.071842	0.221893	0.067798	0.047*
C34	−0.02351 (12)	0.33108 (13)	0.01557 (10)	0.0379 (5)
H34	−0.039638	0.301886	−0.039979	0.0455*
C35	−0.06672 (12)	0.42142 (14)	0.03267 (10)	0.0385 (5)
H35	−0.113709	0.453238	−0.01092	0.0461*
C36	−0.04162 (11)	0.46550 (12)	0.11316 (10)	0.0321 (5)
H36	−0.070483	0.528311	0.123929	0.0386*
O1	0.63327 (8)	0.37352 (10)	0.53505 (8)	0.0392 (4)
O2	0.58197 (10)	0.44006 (14)	0.67133 (9)	0.0614 (6)
O3	0.43608 (10)	0.48129 (12)	0.65684 (9)	0.0549 (5)
O4	0.19464 (9)	0.32143 (13)	0.44743 (10)	0.0569 (5)
O5	0.22764 (11)	0.24248 (13)	0.34091 (10)	0.0631 (6)
O6	0.54745 (10)	0.23529 (12)	0.30214 (8)	0.0518 (5)
O7	0.66627 (9)	0.28940 (12)	0.40564 (9)	0.0507 (5)
N3	0.49861 (10)	0.43835 (11)	0.63197 (9)	0.0379 (4)
N4	0.25133 (10)	0.29121 (12)	0.40756 (10)	0.0428 (5)
C9	0.57563 (13)	0.27360 (13)	0.37128 (12)	0.0398 (6)
C41	0.54458 (10)	0.35627 (11)	0.50735 (10)	0.0298 (4)
C42	0.50987 (11)	0.30564 (12)	0.42622 (10)	0.0314 (5)
C43	0.41587 (11)	0.28489 (12)	0.39522 (10)	0.0329 (5)
H43	0.395087	0.249901	0.342348	0.0394*
C44	0.35106 (10)	0.31453 (12)	0.44039 (10)	0.0313 (4)
C45	0.37850 (10)	0.36477 (12)	0.51759 (10)	0.0305 (4)
H45	0.332901	0.38543	0.547596	0.0366*
C46	0.47336 (11)	0.38456 (11)	0.55054 (9)	0.0290 (4)
H7	0.676841	0.321683	0.458063	0.030 (4)*