x	y	z	Uiso*/Ueq
S1	0.72652 (6)	0.04528 (17)	0.87044 (4)	0.0286 (3)
O2	0.78657 (14)	0.5226 (4)	0.72802 (11)	0.0272 (5)
N1	0.69712 (19)	0.3898 (5)	0.77218 (13)	0.0227 (6)
N2	0.84392 (17)	0.1337 (5)	0.82384 (13)	0.0211 (5)
N3	1.02858 (17)	0.3126 (5)	0.84401 (12)	0.0229 (6)
C1	0.6442 (2)	0.9043 (6)	0.63777 (15)	0.0236 (7)
H1A	0.7034	0.8759	0.6386	0.028*
C2	0.5737 (2)	1.0965 (6)	0.59246 (15)	0.0250 (7)
H2A	0.5853	1.1996	0.5627	0.030*
C3	0.4852 (2)	1.1422 (6)	0.58956 (15)	0.0227 (6)
C4	0.4718 (2)	0.9901 (6)	0.63468 (16)	0.0246 (7)
H4A	0.4128	1.0199	0.6341	0.030*
C5	0.5426 (2)	0.7954 (6)	0.68073 (15)	0.0245 (7)
H5A	0.5315	0.6933	0.7108	0.029*
C6	0.6301 (2)	0.7508 (6)	0.68249 (14)	0.0200 (6)
C7	0.7113 (2)	0.5479 (6)	0.72911 (14)	0.0203 (6)
C8	0.7611 (2)	0.1903 (6)	0.82127 (15)	0.0218 (6)
C9	0.9261 (2)	−0.0462 (6)	0.87572 (15)	0.0240 (7)
H9A	0.9508	−0.1556	0.8523	0.029*
H9B	0.9001	−0.1743	0.8952	0.029*
C10	1.0135 (2)	0.1207 (6)	0.93572 (15)	0.0242 (7)
H10A	0.9874	0.2330	0.9578	0.029*
H10B	1.0650	−0.0066	0.9723	0.029*
C11	1.0649 (2)	0.3085 (6)	0.91261 (15)	0.0224 (6)
C12	1.1454 (2)	0.4739 (6)	0.96253 (16)	0.0282 (7)
H12A	1.1707	0.4633	1.0112	0.034*
C13	1.1880 (2)	0.6550 (7)	0.93981 (18)	0.0315 (8)
H13A	1.2426	0.7710	0.9728	0.038*
C14	1.1503 (2)	0.6643 (6)	0.86918 (18)	0.0323 (8)
H14A	1.1775	0.7882	0.8523	0.039*
C15	1.0716 (2)	0.4885 (6)	0.82314 (17)	0.0269 (7)
H15A	1.0466	0.4919	0.7745	0.032*
C16	0.4073 (2)	1.3480 (6)	0.53901 (16)	0.0279 (7)
H16C	0.3579	1.3783	0.5505	0.042*
H16D	0.3721	1.2787	0.4904	0.042*
H16A	0.4412	1.5211	0.5431	0.042*
H1N2	0.852 (2)	0.242 (7)	0.7974 (17)	0.039 (10)*
H1N1	0.651 (3)	0.424 (9)	0.775 (2)	0.078 (15)*