x	y	z	Uiso*/Ueq
Cl1	0.11705 (11)	0.43257 (8)	0.72492 (11)	0.1116 (6)
Cl2	−0.38901 (14)	0.04807 (9)	0.66545 (14)	0.1333 (7)
O1	0.3761 (2)	0.03250 (17)	1.0499 (2)	0.0784 (9)
H1B	0.3710	0.0047	1.0026	0.118*
O2	0.3562 (2)	0.13615 (16)	0.94718 (18)	0.0613 (7)
O3	0.3744 (2)	0.32764 (19)	0.96664 (19)	0.0684 (8)
O4	0.23091 (17)	0.27469 (14)	0.94386 (16)	0.0485 (6)
O5	0.1328 (2)	0.2233 (2)	0.6314 (2)	0.0748 (8)
O6	0.1459 (2)	0.0990 (2)	0.5886 (2)	0.0887 (10)
O7	−0.1465 (2)	0.39839 (15)	0.55531 (19)	0.0719 (9)
H7A	−0.1519	0.4404	0.5828	0.108*
O8	−0.1401 (2)	0.33919 (14)	0.69075 (19)	0.0596 (7)
O9	−0.11021 (18)	0.16192 (17)	0.77884 (18)	0.0592 (7)
O10	−0.25765 (16)	0.19193 (14)	0.66714 (15)	0.0453 (6)
O11	−0.3413 (3)	0.4576 (2)	0.8743 (2)	0.1134 (14)
O12	−0.3404 (2)	0.3246 (2)	0.8740 (2)	0.0832 (10)
N1	0.11477 (19)	0.16366 (16)	0.7989 (2)	0.0426 (7)
N2	0.1320 (2)	0.03336 (18)	0.8448 (2)	0.0554 (8)
N3	0.1364 (2)	0.1490 (2)	0.6445 (2)	0.0592 (9)
N4	−0.37734 (19)	0.32555 (17)	0.6748 (2)	0.0438 (7)
N5	−0.3757 (2)	0.4369 (2)	0.5904 (2)	0.0597 (9)
N6	−0.3466 (3)	0.3912 (3)	0.8340 (2)	0.0684 (10)
C1	0.3666 (3)	0.3017 (3)	1.1689 (3)	0.0580 (11)
H1A	0.3550	0.3577	1.1582	0.070*
C2	0.3935 (3)	0.2701 (3)	1.2607 (3)	0.0673 (13)
H2B	0.3988	0.3047	1.3117	0.081*
C3	0.4129 (3)	0.1871 (3)	1.2777 (3)	0.0676 (12)
H3A	0.4320	0.1663	1.3402	0.081*
C4	0.4037 (3)	0.1351 (3)	1.2018 (3)	0.0580 (11)
H4A	0.4166	0.0793	1.2133	0.070*
C5	0.3755 (2)	0.1661 (2)	1.1088 (2)	0.0464 (9)
C6	0.3568 (2)	0.2497 (2)	1.0920 (2)	0.0462 (9)
C7	0.3675 (3)	0.1105 (2)	1.0262 (3)	0.0498 (9)
C8	0.3245 (3)	0.2879 (2)	0.9941 (3)	0.0475 (9)
C9	0.1664 (3)	0.3935 (2)	0.8436 (3)	0.0749 (13)
H9A	0.2255	0.4225	0.8812	0.090*
H9B	0.1219	0.4027	0.8740	0.090*
C10	0.1872 (3)	0.3018 (2)	0.8441 (2)	0.0476 (9)
H10A	0.2298	0.2909	0.8110	0.057*
C11	0.0955 (2)	0.2518 (2)	0.7990 (3)	0.0491 (9)
H11A	0.0560	0.2615	0.8349	0.059*
H11B	0.0596	0.2701	0.7328	0.059*
C12	0.1003 (3)	0.1285 (3)	0.9559 (3)	0.0616 (11)
H12A	0.1046	0.0788	0.9918	0.092*
H12B	0.0378	0.1523	0.9380	0.092*
H12C	0.1484	0.1666	0.9954	0.092*
C13	0.1158 (2)	0.1095 (2)	0.8677 (3)	0.0465 (9)
C14	0.1408 (3)	0.0381 (2)	0.7593 (3)	0.0569 (10)
H14A	0.1517	−0.0061	0.7259	0.068*
C15	0.1311 (3)	0.1176 (2)	0.7298 (3)	0.0477 (9)
C17	−0.1188 (3)	0.1073 (2)	0.5763 (3)	0.0552 (10)
H17A	−0.1214	0.0583	0.6069	0.066*
C18	−0.0988 (3)	0.1060 (3)	0.4947 (3)	0.0643 (11)
H18A	−0.0887	0.0560	0.4703	0.077*
C19	−0.0939 (3)	0.1783 (3)	0.4494 (3)	0.0594 (11)
H19A	−0.0811	0.1773	0.3940	0.071*
C20	−0.1079 (2)	0.2521 (2)	0.4867 (2)	0.0477 (9)
H20A	−0.1032	0.3009	0.4568	0.057*
C21	−0.1288 (2)	0.2548 (2)	0.5676 (2)	0.0389 (8)
C22	−0.1352 (2)	0.1814 (2)	0.6130 (2)	0.0399 (8)
C23	−0.1395 (3)	0.3347 (2)	0.6110 (3)	0.0459 (9)
C24	−0.1631 (3)	0.1788 (2)	0.6968 (3)	0.0428 (8)
C25	−0.3119 (3)	0.1052 (3)	0.7666 (3)	0.0737 (13)
H25A	−0.3391	0.1072	0.8147	0.088*
H25B	−0.2503	0.0777	0.7955	0.088*
C26	−0.2968 (3)	0.1925 (2)	0.7394 (3)	0.0491 (9)
H26A	−0.2528	0.2216	0.7972	0.059*
C27	−0.3904 (2)	0.2392 (2)	0.6947 (3)	0.0490 (9)
H27A	−0.4314	0.2125	0.6345	0.059*
H27B	−0.4229	0.2368	0.7384	0.059*
C28	−0.4060 (3)	0.3050 (3)	0.5004 (3)	0.0655 (11)
H28A	−0.4093	0.3398	0.4476	0.098*
H28B	−0.4660	0.2767	0.4832	0.098*
H28C	−0.3553	0.2656	0.5136	0.098*
C29	−0.3866 (3)	0.3556 (2)	0.5877 (3)	0.0494 (9)
C30	−0.3610 (3)	0.4604 (3)	0.6814 (3)	0.0618 (11)
H30A	−0.3517	0.5142	0.7039	0.074*
C31	−0.3617 (3)	0.3934 (2)	0.7348 (3)	0.0508 (9)