x	y	z	Uiso*/Ueq
Cl1	0.30610 (3)	0.21490 (2)	0.23479 (3)	0.01891 (10)
O1	0.45753 (9)	0.41672 (7)	0.37854 (9)	0.0222 (2)
O2	0.18461 (8)	0.47720 (6)	0.01946 (9)	0.0188 (2)
O3	0.66232 (8)	0.16482 (7)	0.41798 (9)	0.0192 (2)
O4	0.77243 (9)	0.14778 (7)	0.06066 (9)	0.0203 (2)
N1	0.34112 (10)	0.44489 (7)	0.18374 (11)	0.0145 (3)
N2	0.49938 (11)	0.29689 (7)	0.14298 (11)	0.0132 (2)
H2A	0.5674 (14)	0.3152 (10)	0.1984 (15)	0.016*
H2B	0.4486 (14)	0.2814 (10)	0.1872 (15)	0.016*
N3	0.68861 (10)	0.15627 (7)	0.22242 (11)	0.0144 (3)
C1	0.36218 (13)	0.42849 (9)	0.31025 (13)	0.0168 (3)
C2	0.24799 (13)	0.43156 (9)	0.33647 (13)	0.0172 (3)
C3	0.21870 (14)	0.41977 (10)	0.44585 (14)	0.0232 (3)
H3	0.275327	0.407303	0.520828	0.028*
C4	0.10228 (15)	0.42703 (10)	0.44106 (15)	0.0264 (4)
H4	0.078868	0.418693	0.514353	0.032*
C5	0.01953 (14)	0.44615 (10)	0.33171 (16)	0.0254 (4)
H5	−0.059106	0.450841	0.331866	0.030*
C6	0.04974 (13)	0.45861 (9)	0.22169 (15)	0.0208 (3)
H6	−0.006455	0.471957	0.146751	0.025*
C7	0.16529 (13)	0.45060 (9)	0.22689 (13)	0.0165 (3)
C8	0.22447 (12)	0.45952 (9)	0.12767 (13)	0.0146 (3)
C9	0.43146 (12)	0.45125 (9)	0.12044 (13)	0.0163 (3)
H9A	0.504935	0.466733	0.181225	0.020*
H9B	0.411828	0.498362	0.058814	0.020*
C10	0.44862 (12)	0.36834 (9)	0.05565 (13)	0.0160 (3)
H10A	0.373203	0.349242	0.001902	0.019*
H10B	0.500022	0.380153	0.002199	0.019*
C11	0.51826 (12)	0.21954 (9)	0.07135 (13)	0.0147 (3)
H11A	0.571103	0.235377	0.021083	0.018*
H11B	0.443688	0.202189	0.014086	0.018*
C12	0.56858 (12)	0.14316 (9)	0.15283 (13)	0.0159 (3)
H12A	0.521779	0.132557	0.211393	0.019*
H12B	0.563460	0.091081	0.100582	0.019*
C13	0.72536 (12)	0.16741 (9)	0.35046 (13)	0.0144 (3)
C14	0.85216 (12)	0.18028 (9)	0.38127 (13)	0.0146 (3)
C15	0.93036 (12)	0.19494 (9)	0.49353 (13)	0.0173 (3)
H15	0.907043	0.196796	0.567657	0.021*
C16	1.04548 (13)	0.20700 (9)	0.49417 (14)	0.0196 (3)
H16	1.101625	0.218356	0.569922	0.024*
C17	1.07905 (12)	0.20260 (9)	0.38529 (14)	0.0192 (3)
H17	1.157746	0.211544	0.387946	0.023*
C18	0.99976 (12)	0.18540 (9)	0.27284 (14)	0.0176 (3)
H18	1.023044	0.180774	0.198902	0.021*
C19	0.88563 (12)	0.17528 (9)	0.27268 (13)	0.0152 (3)
C20	0.78104 (12)	0.15836 (9)	0.16934 (13)	0.0154 (3)
O1W	0.70481 (9)	0.36110 (7)	0.29278 (9)	0.0200 (2)
H1WA	0.715322	0.413414	0.269788	0.030*
H1WB	0.717563	0.364549	0.372498	0.030*
O2W	0.72498 (11)	0.52060 (7)	0.19391 (11)	0.0287 (3)
H2WA	0.758477	0.523958	0.134596	0.043*
H2WB	0.720782	0.573778	0.217062	0.043*