x	y	z	Uiso*/Ueq
Br1	−0.28302 (3)	0.00291 (3)	−0.05646 (2)	0.05606 (10)
O1	−0.21350 (16)	0.2315 (2)	0.07160 (15)	0.0662 (7)
H1A	−0.2478	0.1920	0.0271	0.099*
N1	0.09397 (17)	0.27426 (17)	0.18365 (14)	0.0321 (5)
N2	0.28135 (17)	0.30337 (16)	0.27893 (14)	0.0305 (5)
N3	0.44633 (17)	0.20953 (17)	0.27441 (14)	0.0334 (5)
C1	0.1546 (2)	0.3348 (2)	0.25443 (17)	0.0316 (6)
C2	0.1075 (2)	0.4190 (2)	0.3045 (2)	0.0445 (8)
H2A	0.1547	0.4574	0.3553	0.053*
C3	−0.0135 (3)	0.4434 (3)	0.2752 (2)	0.0531 (9)
H3A	−0.0507	0.4989	0.3068	0.064*
C4	−0.0795 (2)	0.3852 (2)	0.1986 (2)	0.0444 (8)
H4A	−0.1606	0.4034	0.1764	0.053*
C5	−0.0234 (2)	0.2998 (2)	0.15572 (18)	0.0356 (7)
C6	−0.0886 (2)	0.2276 (2)	0.0752 (2)	0.0445 (8)
H6A	−0.0703	0.2563	0.0160	0.053*
H6B	−0.0608	0.1480	0.0832	0.053*
C7	0.3316 (2)	0.2205 (2)	0.23424 (18)	0.0346 (6)
H7A	0.2919	0.1775	0.1830	0.042*
C8	0.3694 (2)	0.3481 (2)	0.34984 (18)	0.0380 (7)
H8A	0.3598	0.4075	0.3916	0.046*
C9	0.4719 (2)	0.2892 (2)	0.34690 (18)	0.0384 (7)
H9A	0.5466	0.3002	0.3866	0.046*
C10	0.5327 (2)	0.1277 (2)	0.24373 (18)	0.0376 (7)
H10A	0.5877	0.1707	0.2121	0.045*
H10B	0.4880	0.0740	0.1982	0.045*
C11	0.6055 (2)	0.0601 (2)	0.32432 (17)	0.0312 (6)
C12	0.7292 (2)	0.0816 (2)	0.35423 (17)	0.0320 (6)
C13	0.7950 (2)	0.0118 (2)	0.42336 (17)	0.0339 (6)
H13A	0.8775	0.0261	0.4427	0.041*
C14	0.7435 (2)	−0.0781 (2)	0.46487 (18)	0.0368 (7)
C15	0.6197 (2)	−0.0969 (2)	0.43645 (18)	0.0370 (7)
H15A	0.5830	−0.1563	0.4645	0.044*
C16	0.5498 (2)	−0.0293 (2)	0.36734 (18)	0.0336 (7)
C17	0.4158 (2)	−0.0533 (3)	0.3403 (2)	0.0470 (8)
H17A	0.3971	−0.1241	0.3696	0.070*
H17B	0.3935	−0.0604	0.2727	0.070*
H17C	0.3713	0.0094	0.3615	0.070*
C18	0.7936 (2)	0.1776 (2)	0.3128 (2)	0.0466 (8)
H18A	0.8792	0.1721	0.3367	0.070*
H18B	0.7643	0.2511	0.3303	0.070*
H18C	0.7783	0.1708	0.2450	0.070*
C19	0.8180 (3)	−0.1551 (3)	0.5387 (2)	0.0521 (8)
H19A	0.9026	−0.1385	0.5423	0.078*
H19B	0.8026	−0.2348	0.5215	0.078*
H19C	0.7963	−0.1408	0.5992	0.078*