x	y	z	Uiso*/Ueq	Occ. (<1)
Br1	0.99977 (4)	0.72535 (2)	0.421420 (19)	0.03009 (9)
S1	0.66855 (8)	0.46246 (6)	0.45787 (4)	0.02458 (16)
O1	1.1493 (2)	0.73022 (18)	0.71856 (13)	0.0311 (5)
O2	1.1039 (3)	0.52832 (19)	0.83761 (14)	0.0368 (5)
O3	1.0313 (3)	0.69989 (19)	0.88526 (14)	0.0408 (6)
C1	0.6729 (3)	0.4794 (3)	0.35854 (18)	0.0263 (6)
C2	0.7753 (3)	0.5611 (2)	0.34871 (18)	0.0236 (6)
C3	0.8510 (3)	0.6105 (2)	0.42277 (17)	0.0212 (6)
C4	0.8073 (3)	0.5679 (2)	0.49033 (17)	0.0203 (6)
C5	0.8539 (3)	0.5935 (2)	0.57634 (17)	0.0197 (6)
C6	0.9826 (3)	0.6524 (2)	0.60774 (18)	0.0214 (6)
C7	1.0306 (3)	0.6775 (2)	0.69339 (18)	0.0225 (6)
C8	0.9305 (3)	0.6373 (2)	0.75173 (17)	0.0213 (6)
C9	0.8343 (3)	0.5321 (2)	0.71617 (17)	0.0208 (6)
C10	0.7514 (3)	0.5522 (2)	0.63266 (16)	0.0206 (6)
C11	0.7227 (3)	0.4959 (2)	0.76997 (17)	0.0209 (6)
C12	0.7020 (3)	0.3799 (2)	0.77736 (19)	0.0285 (7)
C13	0.5923 (4)	0.3416 (3)	0.8206 (2)	0.0361 (8)
C14	0.5035 (4)	0.4191 (3)	0.8572 (2)	0.0374 (8)
C15	0.5246 (4)	0.5351 (3)	0.8508 (2)	0.0350 (7)
C16	0.6338 (3)	0.5729 (2)	0.80828 (18)	0.0263 (6)
C17	1.0313 (3)	0.6139 (2)	0.82876 (18)	0.0251 (6)
C18	1.1320 (5)	0.6868 (4)	0.9614 (2)	0.0555 (11)
C19	1.2037 (10)	0.8086 (8)	0.9813 (5)	0.0623 (17)	0.513 (6)
C19'	1.0611 (10)	0.5946 (9)	1.0106 (5)	0.0623 (17)	0.487 (6)
Br2	0.50916 (3)	0.75741 (2)	0.418423 (18)	0.02812 (9)
S2	0.16982 (8)	1.01911 (6)	0.45701 (4)	0.02397 (16)
O4	0.6550 (2)	0.81534 (18)	0.71690 (13)	0.0306 (5)
O5	0.6026 (2)	1.03913 (17)	0.84067 (13)	0.0324 (5)
O6	0.5409 (2)	0.86917 (17)	0.88122 (12)	0.0286 (5)
C20	0.1748 (3)	0.9822 (3)	0.35764 (18)	0.0261 (6)
C21	0.2799 (3)	0.9014 (2)	0.34699 (18)	0.0241 (6)
C22	0.3574 (3)	0.8687 (2)	0.42091 (17)	0.0201 (6)
C23	0.3116 (3)	0.9236 (2)	0.48873 (17)	0.0195 (6)
C24	0.3592 (3)	0.9170 (2)	0.57463 (17)	0.0186 (6)
C25	0.4871 (3)	0.8656 (2)	0.60608 (17)	0.0215 (6)
C26	0.5353 (3)	0.8602 (2)	0.69166 (18)	0.0217 (6)
C27	0.4338 (3)	0.9107 (2)	0.75024 (16)	0.0190 (6)
C28	0.3404 (3)	1.0092 (2)	0.71490 (16)	0.0191 (6)
C29	0.2568 (3)	0.9709 (2)	0.63110 (16)	0.0202 (6)
C30	0.2268 (3)	1.0582 (2)	0.76721 (17)	0.0218 (6)
C31	0.1404 (3)	0.9897 (3)	0.80725 (19)	0.0290 (7)
C32	0.0259 (4)	1.0375 (3)	0.8464 (2)	0.0387 (8)
C33	−0.0024 (4)	1.1527 (3)	0.8463 (2)	0.0412 (9)
C34	0.0858 (4)	1.2217 (3)	0.8088 (2)	0.0396 (8)
C35	0.1999 (4)	1.1751 (3)	0.76958 (18)	0.0293 (7)
C36	0.5346 (3)	0.9491 (2)	0.82818 (18)	0.0225 (6)
C37	0.6474 (4)	0.8921 (3)	0.9551 (2)	0.0422 (9)
C38	0.6280 (6)	0.7991 (4)	1.0081 (3)	0.0655 (13)
H1	0.6111	0.4369	0.3155	0.032*
H2	0.7940	0.5825	0.2977	0.028*
H6	1.0451	0.6788	0.5716	0.026*
H8	0.8608	0.7005	0.7640	0.026*
H9	0.9050	0.4673	0.7097	0.025*
H10A	0.7006	0.4800	0.6083	0.025*
H10B	0.6718	0.6095	0.6383	0.025*
H12	0.7632	0.3260	0.7526	0.034*
H13	0.5787	0.2620	0.8250	0.043*
H14	0.4284	0.3933	0.8865	0.045*
H15	0.4635	0.5888	0.8758	0.042*
H16	0.6484	0.6527	0.8052	0.032*
H18A	1.2102	0.6289	0.9544	0.067*	0.513 (6)
H18B	1.0740	0.6651	1.0040	0.067*	0.513 (6)
H19A	1.2746	0.8103	1.0317	0.093*	0.513 (6)
H19B	1.1235	0.8640	0.9872	0.093*	0.513 (6)
H19C	1.2581	0.8283	0.9376	0.093*	0.513 (6)
H18C	1.1448	0.7611	0.9939	0.067*	0.487 (6)
H18D	1.2330	0.6618	0.9500	0.067*	0.487 (6)
H19D	1.1287	0.5856	1.0610	0.093*	0.487 (6)
H19E	1.0488	0.5211	0.9784	0.093*	0.487 (6)
H19F	0.9619	0.6203	1.0226	0.093*	0.487 (6)
H20	0.1117	1.0143	0.3149	0.031*
H21	0.2992	0.8704	0.2958	0.029*
H25	0.5490	0.8310	0.5700	0.026*
H27	0.3627	0.8495	0.7611	0.023*
H28	0.4128	1.0723	0.7087	0.023*
H29A	0.1761	0.9149	0.6366	0.024*
H29B	0.2074	1.0379	0.6068	0.024*
H31	0.1593	0.9102	0.8080	0.035*
H32	−0.0334	0.9900	0.8735	0.046*
H33	−0.0823	1.1843	0.8720	0.049*
H34	0.0684	1.3016	0.8097	0.048*
H35	0.2606	1.2236	0.7440	0.035*
H37A	0.6266	0.9671	0.9820	0.051*
H37B	0.7527	0.8938	0.9429	0.051*
H38A	0.5228	0.7968	1.0185	0.098*
H38B	0.6961	0.8135	1.0592	0.098*
H38C	0.6524	0.7257	0.9816	0.098*