x	y	z	Uiso*/Ueq
O2	0.34000 (12)	0.73324 (9)	0.04196 (10)	0.0465 (3)
H2	0.347012	0.797633	0.056037	0.070*
O3	0.52685 (12)	0.84064 (9)	0.20703 (10)	0.0473 (3)
O1	0.32775 (12)	0.52385 (9)	0.03728 (11)	0.0530 (4)
O4	1.04377 (13)	0.24711 (10)	0.85736 (10)	0.0524 (3)
N1	0.76944 (13)	0.53851 (10)	0.50837 (11)	0.0388 (3)
C10	0.83876 (15)	0.46251 (12)	0.59633 (13)	0.0350 (4)
C15	0.93325 (16)	0.39274 (12)	0.57930 (14)	0.0369 (4)
H15	0.951974	0.392859	0.507304	0.044*
C8	0.61237 (15)	0.56465 (13)	0.31098 (13)	0.0355 (4)
C4	0.42672 (15)	0.56804 (13)	0.12973 (13)	0.0371 (4)
C6	0.53028 (15)	0.73189 (12)	0.21930 (13)	0.0344 (4)
C14	1.00014 (16)	0.32282 (12)	0.66827 (14)	0.0384 (4)
H14	1.064957	0.277361	0.656291	0.046*
C7	0.61974 (15)	0.67549 (13)	0.30970 (13)	0.0361 (4)
H7	0.684472	0.711472	0.369303	0.043*
C9	0.69704 (15)	0.50052 (13)	0.40957 (14)	0.0377 (4)
H9	0.697878	0.426753	0.399120	0.045*
C5	0.43155 (15)	0.67913 (13)	0.13033 (13)	0.0345 (4)
C3	0.51728 (16)	0.51059 (13)	0.21959 (14)	0.0386 (4)
H3	0.514739	0.436151	0.219040	0.046*
C13	0.97179 (16)	0.31969 (13)	0.77481 (14)	0.0380 (4)
C11	0.81296 (18)	0.46051 (15)	0.70406 (15)	0.0486 (5)
H11	0.751385	0.508458	0.717490	0.058*
C12	0.87678 (18)	0.38867 (16)	0.79243 (16)	0.0505 (5)
H12	0.855831	0.386815	0.863378	0.061*
C2	0.6266 (2)	0.90036 (14)	0.29204 (16)	0.0546 (5)
H2B	0.615906	0.975079	0.272312	0.082*
H2C	0.713615	0.877111	0.291596	0.082*
H2D	0.617836	0.889302	0.369713	0.082*
C1	0.3232 (2)	0.41090 (15)	0.02729 (18)	0.0603 (5)
H1A	0.255752	0.390654	−0.044946	0.090*
H1B	0.302110	0.380713	0.094094	0.090*
H1C	0.408703	0.384713	0.025963	0.090*
C16	1.0104 (2)	0.2356 (2)	0.96441 (19)	0.0743 (7)
H16A	0.918409	0.214220	0.945995	0.111*
H16B	1.023357	0.302705	1.006081	0.111*
H16C	1.066751	0.182152	1.013549	0.111*