x	y	z	Uiso*/Ueq
C1	1.01092 (19)	0.2867 (2)	0.42850 (12)	0.0320 (5)
C2	1.08964 (19)	0.3142 (2)	0.47986 (13)	0.0352 (5)
C3	1.1400 (2)	0.4186 (2)	0.48146 (15)	0.0458 (6)
H3	1.1912	0.4360	0.5168	0.055*
C4	1.1134 (2)	0.4975 (2)	0.42959 (15)	0.0503 (7)
H4	1.1473	0.5684	0.4298	0.060*
C5	1.0369 (2)	0.4717 (2)	0.37750 (15)	0.0496 (7)
H5	1.0201	0.5249	0.3424	0.060*
C6	0.9851 (2)	0.3670 (2)	0.37733 (14)	0.0413 (6)
H6	0.9326	0.3505	0.3426	0.050*
C7	1.0522 (2)	0.0708 (2)	0.31993 (13)	0.0344 (5)
C8	1.13311 (19)	−0.01632 (19)	0.29607 (12)	0.0332 (5)
C9	1.2011 (2)	0.0112 (2)	0.23910 (13)	0.0400 (6)
H9	1.1942	0.0816	0.2170	0.048*
C10	1.2786 (2)	−0.0652 (2)	0.21516 (14)	0.0436 (6)
H10	1.3247	−0.0458	0.1773	0.052*
C11	1.2882 (2)	−0.1697 (2)	0.24688 (14)	0.0482 (7)
H11	1.3412	−0.2209	0.2309	0.058*
C12	1.2194 (3)	−0.1986 (2)	0.30227 (16)	0.0589 (8)
H12	1.2252	−0.2701	0.3231	0.071*
C13	1.1419 (2)	−0.1227 (2)	0.32734 (14)	0.0482 (7)
H13	1.0959	−0.1428	0.3650	0.058*
N1	1.01881 (17)	0.06273 (17)	0.39120 (11)	0.0355 (5)
H1N	1.051 (2)	0.021 (2)	0.4206 (12)	0.043*
N2	1.12183 (18)	0.2319 (2)	0.53570 (13)	0.0467 (6)
O1	0.84056 (14)	0.17061 (15)	0.38774 (10)	0.0455 (5)
O2	0.92831 (15)	0.11935 (15)	0.50171 (9)	0.0418 (4)
O3	1.01759 (16)	0.14595 (15)	0.28213 (9)	0.0468 (5)
O4	1.09678 (19)	0.2545 (2)	0.59685 (11)	0.0660 (6)
O5	1.1726 (2)	0.14835 (19)	0.51681 (13)	0.0695 (6)
S1	0.93749 (5)	0.15669 (5)	0.42926 (3)	0.03293 (17)