x	y	z	Uiso*/Ueq
Br	−0.00062 (5)	0.75926 (3)	0.23886 (3)	0.05362 (18)
O1	0.3113 (3)	1.07458 (17)	−0.03054 (18)	0.0478 (6)
O2	−0.0433 (2)	1.01275 (15)	0.35066 (16)	0.0358 (5)
N1	0.1775 (3)	0.93324 (16)	0.42004 (18)	0.0306 (5)
H1A	0.1550	0.9465	0.4941	0.037*
N2	0.3148 (3)	0.87860 (17)	0.39363 (19)	0.0318 (5)
C1	0.0954 (3)	0.85866 (18)	0.1528 (2)	0.0305 (5)
C2	0.1316 (4)	0.8445 (2)	0.0351 (2)	0.0361 (6)
H2A	0.1073	0.7858	−0.0012	0.043*
C3	0.2033 (3)	0.9154 (2)	−0.0303 (2)	0.0316 (6)
H3A	0.2285	0.9056	−0.1111	0.038*
C4	0.2379 (3)	1.00067 (19)	0.0234 (2)	0.0294 (5)
C5	0.1981 (3)	1.01479 (18)	0.1415 (2)	0.0285 (5)
H5A	0.2195	1.0739	0.1775	0.034*
C6	0.1282 (3)	0.94403 (17)	0.2066 (2)	0.0244 (5)
C7	0.3619 (4)	1.0618 (3)	−0.1501 (3)	0.0525 (9)
H7A	0.4202	1.1181	−0.1766	0.079*
H7B	0.2644	1.0512	−0.2012	0.079*
H7C	0.4357	1.0075	−0.1544	0.079*
C8	0.0802 (3)	0.96538 (18)	0.3318 (2)	0.0258 (5)
C9	0.4048 (3)	0.8504 (2)	0.4794 (2)	0.0357 (6)
C10	0.3829 (5)	0.8738 (3)	0.6083 (3)	0.0624 (12)
H10A	0.2676	0.8632	0.6295	0.094*
H10B	0.4118	0.9397	0.6221	0.094*
H10C	0.4551	0.8336	0.6570	0.094*
C11	0.5478 (4)	0.7880 (3)	0.4479 (3)	0.0485 (8)
H11A	0.5308	0.7253	0.4835	0.058*
H11B	0.5486	0.7800	0.3609	0.058*
C12	0.7109 (5)	0.8246 (4)	0.4882 (5)	0.0764 (13)
H12A	0.7969	0.7786	0.4702	0.115*
H12B	0.7097	0.8357	0.5738	0.115*
H12C	0.7339	0.8837	0.4472	0.115*