x	y	z	Uiso*/Ueq	Occ. (<1)
C1	0.7021 (3)	0.32502 (19)	0.34879 (14)	0.0205 (5)
H1	0.8227	0.3214	0.3471	0.025*
C2	0.6435 (3)	0.4253 (2)	0.31127 (15)	0.0211 (5)
H2	0.5234	0.4232	0.3059	0.025*
C3	0.6921 (3)	0.52070 (19)	0.35853 (15)	0.0215 (5)
H3	0.8113	0.5310	0.3535	0.026*
C4	0.6518 (3)	0.5082 (2)	0.44263 (16)	0.0226 (6)
H4	0.7071	0.5646	0.4721	0.027*
C5	0.7119 (4)	0.4031 (2)	0.47122 (15)	0.0235 (6)
H5	0.8323	0.4017	0.4671	0.028*
C6	0.6658 (4)	0.3832 (2)	0.55375 (16)	0.0279 (6)
H61	0.6722	0.4494	0.5826	0.033*
H62	0.5526	0.3585	0.5559	0.033*
O1	0.6358 (2)	0.24111 (13)	0.30922 (11)	0.0217 (4)
O2	0.7150 (2)	0.43673 (14)	0.23805 (11)	0.0241 (4)
H2O	0.6648	0.4055	0.2024	0.029*
O3	0.6135 (3)	0.61167 (14)	0.33229 (11)	0.0261 (5)
H3O	0.6709	0.6420	0.2988	0.031*
O4	0.4818 (3)	0.51573 (15)	0.45519 (11)	0.0268 (5)
H4O	0.4508	0.5788	0.4331	0.032*
O5	0.6475 (2)	0.31996 (13)	0.42597 (10)	0.0219 (4)
O6	0.7678 (3)	0.30802 (14)	0.58916 (11)	0.0266 (5)
H6O	0.7491	0.2462	0.5742	0.032*
C7	0.8597 (3)	−0.00264 (19)	0.25298 (15)	0.0220 (5)
H71	0.8919	−0.0327	0.2025	0.026*	0.77
H72	0.9533	0.0120	0.2874	0.026*	0.23
C8	0.7699 (3)	0.10082 (19)	0.24040 (15)	0.0213 (5)
H8	0.6707	0.0870	0.2094	0.026*
C9	0.7191 (3)	0.14403 (19)	0.31837 (15)	0.0206 (5)
H9	0.8171	0.1549	0.3508	0.025*
C10	0.6100 (3)	0.06275 (19)	0.35568 (15)	0.0213 (5)
H10	0.5151	0.0491	0.3218	0.026*
C11	0.7058 (3)	−0.03748 (19)	0.36589 (15)	0.0218 (5)
H11	0.8047	−0.0211	0.3964	0.026*
C12	0.6157 (4)	−0.1242 (2)	0.40603 (16)	0.0248 (6)
H121	0.6855	−0.1866	0.4092	0.030*
H122	0.5888	−0.1022	0.4587	0.030*
O71	0.9959 (3)	0.01943 (18)	0.29538 (14)	0.0217 (5)	0.77
H71O	1.0752	−0.0218	0.2860	0.026*	0.77
O72	0.9226 (12)	−0.0517 (7)	0.1856 (5)	0.031 (2)	0.23
H72O	0.8861	−0.0216	0.1467	0.037*	0.23
O10	0.5548 (3)	0.09459 (15)	0.42885 (11)	0.0251 (5)
H10O	0.4729	0.1468	0.4241	0.030*
O11	0.7561 (2)	−0.07395 (14)	0.29198 (11)	0.0229 (4)
O12	0.4722 (3)	−0.1495 (2)	0.36648 (17)	0.0485 (7)
H12O	0.4325	−0.2091	0.3760	0.058*
N1	0.8734 (3)	0.17181 (16)	0.19831 (13)	0.0214 (5)
H1N	0.9621	0.1942	0.2205	0.026*
C13	0.8410 (3)	0.20474 (19)	0.12798 (16)	0.0220 (6)
O13	0.7167 (3)	0.18034 (14)	0.09211 (11)	0.0258 (4)
C14	0.9628 (4)	0.2771 (2)	0.09275 (17)	0.0312 (7)
H141	1.0519	0.2884	0.1287	0.047*
H142	0.9112	0.3438	0.0810	0.047*
H143	1.0048	0.2461	0.0456	0.047*
O1W	0.2143 (3)	0.39008 (16)	0.43738 (13)	0.0370 (6)
H11W	0.1688	0.3974	0.4806	0.044*
H12W	0.2950	0.4330	0.4398	0.044*
O2W	0.8087 (2)	0.72473 (14)	0.24058 (11)	0.0247 (4)
H21W	0.7630	0.7867	0.2498	0.030*
H22W	0.7901	0.7083	0.1942	0.030*