x	y	z	Uiso*/Ueq
C1	0.7961 (5)	0.0222 (7)	0.6839 (2)	0.0317 (8)
C2	0.6344 (4)	−0.0621 (8)	0.6312 (2)	0.0330 (8)
C3	0.6332 (5)	−0.2221 (8)	0.5700 (2)	0.0369 (9)
C4	0.7955 (5)	−0.3400 (8)	0.5399 (2)	0.0369 (9)
Br1	0.42183 (5)	0.08537 (10)	0.66527 (3)	0.05260 (18)
O1	0.8584 (3)	−0.1231 (6)	0.73530 (16)	0.0440 (7)
O2	0.8501 (4)	0.2664 (6)	0.66922 (17)	0.0493 (8)
O3	0.9456 (3)	−0.2426 (6)	0.56482 (17)	0.0466 (7)
O4	0.7746 (4)	−0.5294 (6)	0.49066 (17)	0.0482 (8)
H3A	0.5236	−0.2646	0.5439	0.044*
H2	0.9357	0.3049	0.7000	0.074*
H3	1.0256	−0.3258	0.5449	0.070*