x	y	z	Uiso*/Ueq
S1A	0.33370 (9)	0.09248 (2)	0.49476 (9)	0.0225 (2)
O11A	0.4293 (3)	0.11377 (7)	0.6420 (3)	0.0308 (7)
O12A	0.1986 (3)	0.06331 (7)	0.4858 (3)	0.0300 (7)
N1A	0.0333 (4)	0.16571 (9)	0.1560 (3)	0.0347 (9)
N2A	0.2414 (3)	0.13221 (8)	0.3706 (3)	0.0279 (8)
N3A	0.0595 (4)	0.09249 (9)	0.1533 (3)	0.0318 (8)
N41A	0.8562 (4)	0.00864 (9)	0.2912 (4)	0.0352 (9)
C2A	0.1081 (4)	0.12918 (10)	0.2241 (4)	0.0271 (9)
C4A	−0.0789 (5)	0.09197 (13)	0.0121 (4)	0.0394 (11)
C5A	−0.1668 (5)	0.12839 (15)	−0.0589 (4)	0.0487 (13)
C6A	−0.1059 (5)	0.16547 (14)	0.0136 (4)	0.0460 (14)
C11A	0.4832 (4)	0.06863 (9)	0.4269 (4)	0.0209 (8)
C21A	0.4332 (4)	0.03461 (10)	0.3223 (4)	0.0281 (9)
C31A	0.5563 (4)	0.01481 (10)	0.2778 (4)	0.0306 (10)
C41A	0.7336 (4)	0.02831 (9)	0.3364 (4)	0.0257 (9)
C42A	−0.1332 (6)	0.05060 (14)	−0.0664 (5)	0.0582 (16)
C51A	0.7806 (4)	0.06280 (10)	0.4394 (4)	0.0279 (9)
C61A	0.6577 (4)	0.08258 (9)	0.4841 (4)	0.0250 (9)
C62A	−0.1833 (7)	0.20700 (16)	−0.0541 (6)	0.0709 (17)
O2	0.5067 (5)	0.25084 (9)	0.7126 (4)	0.0712 (11)
O11	0.1194 (4)	0.24106 (9)	0.2706 (4)	0.0589 (11)
O12	0.2967 (4)	0.21077 (8)	0.4967 (4)	0.0606 (10)
O31	0.8156 (5)	0.34132 (12)	0.8480 (5)	0.0813 (16)
O32	0.6599 (6)	0.30963 (12)	0.9593 (4)	0.0868 (16)
O51	0.3439 (7)	0.42888 (10)	0.4234 (4)	0.0993 (19)
O52	0.1099 (6)	0.39640 (11)	0.2632 (5)	0.0763 (16)
N3	0.6791 (5)	0.32438 (11)	0.8427 (5)	0.0557 (15)
N5	0.2539 (7)	0.39791 (10)	0.3752 (5)	0.0568 (16)
C1	0.3126 (5)	0.28407 (11)	0.4776 (5)	0.0429 (11)
C2	0.4505 (6)	0.28519 (11)	0.6290 (5)	0.0462 (15)
C3	0.5295 (6)	0.32354 (12)	0.6872 (5)	0.0456 (14)
C4	0.4725 (6)	0.36005 (11)	0.6024 (5)	0.0483 (15)
C5	0.3300 (6)	0.35804 (11)	0.4587 (5)	0.0485 (14)
C6	0.2494 (6)	0.32095 (11)	0.3902 (5)	0.0464 (15)
C11	0.2342 (6)	0.24260 (11)	0.4069 (6)	0.0489 (15)
H1A	0.07050	0.18920	0.20720	0.0420*
H2A	0.26120	0.15340	0.41760	0.0330*
H5A	−0.26560	0.12730	−0.15450	0.0580*
H21A	0.31660	0.02540	0.28290	0.0340*
H31A	0.52240	−0.00780	0.20800	0.0370*
H41A	0.83560	−0.01550	0.26240	0.0420*
H42A	0.95960	0.01430	0.34240	0.0420*
H43A	−0.17740	0.03360	−0.00190	0.0870*
H44A	−0.03300	0.03720	−0.07680	0.0870*
H45A	−0.22420	0.05430	−0.17100	0.0870*
H51A	0.89660	0.07240	0.47790	0.0330*
H61A	0.69090	0.10540	0.55300	0.0300*
H63A	−0.15940	0.22670	0.03180	0.1070*
H64A	−0.30880	0.20420	−0.11010	0.1070*
H65A	−0.13110	0.21660	−0.12740	0.1070*
H4	0.52880	0.38530	0.64130	0.0580*
H6	0.15680	0.32050	0.29020	0.0560*
H12	0.38970	0.21900	0.59520	0.0730*