x	y	z	Uiso*/Ueq
S1	0.07397 (7)	0.09512 (5)	0.38158 (2)	0.02357 (19)
O1	0.15979 (17)	0.01544 (15)	0.50523 (6)	0.0235 (4)
O2	0.13357 (18)	0.31521 (14)	0.40290 (6)	0.0234 (4)
O3	−0.03571 (16)	0.26390 (15)	0.51261 (6)	0.0209 (4)
N1	0.15610 (19)	0.17543 (16)	0.45864 (6)	0.0154 (4)
N2	0.1867 (2)	0.25414 (17)	0.49260 (6)	0.0164 (4)
C1	0.1250 (2)	0.2144 (2)	0.41525 (8)	0.0169 (5)
C2	0.0969 (3)	−0.0098 (2)	0.42684 (8)	0.0193 (5)
C3	0.1398 (2)	0.0567 (2)	0.46830 (8)	0.0171 (5)
C4	0.0839 (2)	0.28924 (18)	0.52017 (8)	0.0134 (5)
C5	0.1292 (2)	0.35908 (19)	0.56150 (8)	0.0154 (5)
C6	0.1110 (2)	0.27896 (19)	0.60228 (8)	0.0161 (5)
C7	0.2173 (3)	0.2042 (2)	0.61513 (8)	0.0214 (5)
C8	0.2021 (3)	0.1278 (2)	0.65112 (9)	0.0231 (6)
C9	0.0800 (3)	0.1236 (2)	0.67589 (8)	0.0186 (5)
C10	−0.0259 (3)	0.1977 (2)	0.66277 (8)	0.0199 (5)
C11	−0.0112 (3)	0.2746 (2)	0.62666 (8)	0.0191 (5)
C12	0.0669 (3)	0.0436 (2)	0.71635 (8)	0.0225 (5)
C13	0.1343 (3)	0.0931 (2)	0.75930 (8)	0.0241 (6)
C14	0.0692 (4)	0.2092 (3)	0.77362 (11)	0.0338 (7)
C15	0.1251 (4)	0.0031 (3)	0.79731 (10)	0.0343 (7)
C16	0.0467 (3)	0.4732 (2)	0.56402 (9)	0.0211 (5)
H2A	0.018 (3)	−0.046 (3)	0.4334 (10)	0.037 (8)*
H2B	0.166 (3)	−0.062 (2)	0.4197 (9)	0.029 (7)*
H5	0.231 (3)	0.381 (2)	0.5594 (8)	0.014 (6)*
H7	0.299 (3)	0.204 (2)	0.5973 (9)	0.027 (7)*
H8	0.277 (3)	0.074 (2)	0.6603 (9)	0.023 (7)*
H10	−0.111 (3)	0.198 (2)	0.6778 (8)	0.016 (6)*
H11	−0.083 (3)	0.326 (3)	0.6170 (9)	0.028 (7)*
H12A	0.107 (3)	−0.031 (2)	0.7094 (9)	0.023 (7)*
H12B	−0.031 (3)	0.031 (2)	0.7228 (8)	0.015 (6)*
H13	0.232 (3)	0.109 (2)	0.7529 (10)	0.034 (8)*
H14A	0.109 (3)	0.239 (3)	0.7992 (11)	0.037 (8)*
H14B	−0.031 (3)	0.197 (3)	0.7814 (10)	0.038 (8)*
H14C	0.075 (3)	0.270 (3)	0.7520 (11)	0.046 (9)*
H15A	0.167 (3)	0.035 (3)	0.8251 (11)	0.042 (9)*
H15B	0.029 (3)	−0.021 (3)	0.8030 (10)	0.039 (8)*
H15C	0.171 (3)	−0.073 (3)	0.7888 (10)	0.036 (8)*
H16A	−0.054 (3)	0.457 (2)	0.5618 (9)	0.030 (8)*
H16B	0.078 (3)	0.527 (2)	0.5401 (9)	0.024 (7)*
H16C	0.063 (3)	0.507 (3)	0.5937 (10)	0.032 (8)*
H1N2	0.271 (3)	0.270 (2)	0.4968 (9)	0.031 (8)*