x	y	z	Uiso*/Ueq
C1	0.10831 (12)	−0.03982 (13)	0.29919 (16)	0.0302 (4)
C2	0.16209 (12)	0.04483 (12)	0.33939 (15)	0.0273 (4)
C3	0.15943 (12)	0.06548 (13)	0.46280 (15)	0.0302 (4)
C4	0.13013 (12)	−0.00186 (13)	0.52880 (16)	0.0335 (4)
C5	0.08565 (12)	−0.10239 (13)	0.37313 (16)	0.0315 (4)
C6	0.04187 (16)	−0.22940 (16)	0.45722 (19)	0.0509 (6)
H6A	0.0818	−0.2808	0.4694	0.061*
H6B	−0.0174	−0.2508	0.4555	0.061*
C7	0.06850 (15)	−0.15800 (14)	0.54656 (19)	0.0421 (5)
H7A	0.0184	−0.1374	0.5759	0.051*
H7B	0.1133	−0.1808	0.6078	0.051*
C8	0.12622 (12)	0.12869 (13)	0.26493 (15)	0.0305 (4)
C9	0.26599 (13)	0.10750 (13)	0.24292 (16)	0.0327 (4)
C10	0.25462 (12)	0.03862 (12)	0.31650 (15)	0.0291 (4)
C11	0.32166 (12)	−0.02155 (14)	0.35672 (16)	0.0363 (5)
H11	0.3146	−0.0680	0.4059	0.044*
C12	0.39967 (14)	−0.01014 (17)	0.32108 (19)	0.0461 (5)
C13	0.41184 (14)	0.05743 (17)	0.2473 (2)	0.0498 (6)
H13	0.4653	0.0626	0.2250	0.060*
C14	0.34405 (14)	0.11796 (16)	0.20630 (18)	0.0449 (5)
H14	0.3509	0.1637	0.1562	0.054*
C31	0.18598 (14)	0.15050 (13)	0.51348 (17)	0.0376 (5)
C32	0.23171 (13)	0.22376 (13)	0.46127 (16)	0.0346 (4)
C33	0.31931 (14)	0.21652 (15)	0.45811 (19)	0.0452 (5)
H33	0.3489	0.1621	0.4781	0.054*
C34	0.36363 (16)	0.29024 (19)	0.4251 (2)	0.0608 (6)
H34	0.4228	0.2845	0.4230	0.073*
C35	0.3216 (2)	0.37187 (19)	0.3955 (2)	0.0621 (7)
C36	0.23388 (18)	0.37875 (16)	0.3996 (2)	0.0515 (6)
H36	0.2043	0.4332	0.3798	0.062*
C37	0.18933 (14)	0.30590 (14)	0.43283 (16)	0.0381 (5)
H37	0.1304	0.3120	0.4361	0.046*
C38	0.3699 (3)	0.4543 (3)	0.3619 (4)	0.1206 (16)
H38A	0.3299	0.5046	0.3458	0.181*
H38B	0.3926	0.4399	0.2965	0.181*
H38C	0.4175	0.4703	0.4223	0.181*
N1	0.09080 (11)	−0.06034 (12)	0.18652 (14)	0.0389 (4)
N2	0.12708 (14)	0.00993 (13)	0.63557 (15)	0.0548 (5)
H2A	0.1089	−0.0333	0.6725	0.066*
H2B	0.1433	0.0608	0.6680	0.066*
N3	0.19037 (10)	0.16040 (11)	0.21672 (13)	0.0336 (4)
H3	0.1854	0.2078	0.1746	0.040*
N4	0.10306 (11)	−0.08480 (10)	0.48544 (13)	0.0342 (4)
N5	0.04712 (11)	−0.18207 (12)	0.35518 (15)	0.0412 (4)
H5	0.0271	−0.2038	0.2894	0.049*
O1	0.05241 (12)	−0.13281 (11)	0.15117 (13)	0.0546 (4)
O2	0.11477 (11)	−0.00570 (11)	0.12016 (12)	0.0494 (4)
O3	0.05189 (9)	0.15950 (10)	0.25570 (12)	0.0413 (4)
O4	0.17505 (15)	0.17071 (11)	0.60983 (14)	0.0669 (5)
Br1	0.493532 (17)	−0.09216 (2)	0.37527 (3)	0.07818 (15)