x	y	z	Uiso*/Ueq
C1	0.5239 (3)	0.9609 (2)	0.16131 (19)	0.0406 (6)
C2	0.4792 (3)	1.0177 (2)	0.2262 (2)	0.0545 (8)
H2	0.4971	1.0808	0.2272	0.065*
C3	0.4077 (3)	0.9774 (3)	0.2886 (2)	0.0624 (9)
H3	0.3769	1.0139	0.3328	0.075*
C4	0.3802 (3)	0.8829 (3)	0.2873 (2)	0.0597 (9)
H4	0.3326	0.8573	0.3310	0.072*
C5	0.4221 (3)	0.8274 (2)	0.2225 (2)	0.0488 (7)
H5	0.4023	0.7645	0.2214	0.059*
C6	0.4952 (3)	0.8669 (2)	0.15814 (19)	0.0393 (6)
C7	0.5591 (3)	0.82841 (18)	0.08476 (18)	0.0363 (6)
C8	0.6265 (3)	0.89955 (18)	0.04518 (18)	0.0368 (6)
C9	0.7036 (3)	0.88394 (19)	−0.02381 (18)	0.0396 (6)
H9	0.7454	0.9326	−0.0505	0.048*
C10	0.7173 (3)	0.79316 (19)	−0.05237 (18)	0.0366 (6)
C11	0.6474 (3)	0.72050 (18)	−0.01624 (17)	0.0370 (6)
C12	0.5667 (3)	0.73930 (18)	0.05171 (18)	0.0363 (6)
C13	0.3650 (3)	0.6679 (3)	0.0589 (2)	0.0654 (10)
H13A	0.3240	0.7248	0.0748	0.098*
H13B	0.3216	0.6168	0.0848	0.098*
H13C	0.3600	0.6614	−0.0028	0.098*
C14	0.8317 (3)	1.0435 (2)	0.1570 (2)	0.0443 (7)
C15	0.9401 (3)	1.0058 (2)	0.1228 (2)	0.0546 (8)
H15	0.9433	0.9957	0.0636	0.065*
C16	1.0440 (4)	0.9831 (3)	0.1767 (3)	0.0678 (10)
H16	1.1179	0.9574	0.1541	0.081*
C17	1.0389 (4)	0.9983 (3)	0.2642 (3)	0.0755 (12)
H17	1.1099	0.9838	0.3006	0.091*
C18	0.9288 (4)	1.0349 (4)	0.2979 (3)	0.0779 (12)
H18	0.9251	1.0441	0.3572	0.093*
C19	0.8250 (4)	1.0576 (3)	0.2448 (2)	0.0641 (10)
H19	0.7505	1.0824	0.2675	0.077*
C20	0.8034 (3)	0.77497 (18)	−0.12588 (17)	0.0372 (6)
C21	0.7515 (3)	0.7773 (2)	−0.2098 (2)	0.0536 (8)
H21	0.6637	0.7901	−0.2192	0.064*
C22	0.8278 (4)	0.7609 (3)	−0.2803 (2)	0.0641 (10)
H22	0.7906	0.7626	−0.3360	0.077*
C23	0.9561 (4)	0.7425 (3)	−0.2683 (2)	0.0633 (10)
H23	1.0071	0.7328	−0.3157	0.076*
C24	1.0099 (3)	0.7381 (2)	−0.1871 (2)	0.0531 (8)
H24	1.0975	0.7240	−0.1786	0.064*
C25	0.9345 (3)	0.75469 (19)	−0.11715 (17)	0.0386 (6)
C26	0.6569 (3)	0.6230 (2)	−0.0488 (2)	0.0472 (7)
H26A	0.6094	0.5762	−0.0237	0.057*
H26B	0.7103	0.6095	−0.0940	0.057*
N1	0.6006 (2)	0.98366 (15)	0.08997 (16)	0.0407 (5)
N2	1.0011 (3)	0.7494 (2)	−0.03198 (18)	0.0520 (7)
O1	0.9650 (3)	0.7991 (2)	0.02487 (15)	0.0771 (8)
O2	1.0921 (3)	0.6960 (2)	−0.0230 (2)	0.0881 (9)
O3	0.6318 (3)	1.14928 (15)	0.12702 (17)	0.0634 (6)
O4	0.7410 (3)	1.08277 (15)	0.00314 (15)	0.0575 (6)
O5	0.4979 (2)	0.66924 (14)	0.08849 (14)	0.0482 (5)
S1	0.69953 (8)	1.07490 (5)	0.08859 (5)	0.0460 (2)
Br1	0.80182 (4)	0.55845 (2)	0.01227 (2)	0.06233 (16)