x	y	z	Uiso*/Ueq
O1A	0.40087 (16)	0.0190 (4)	0.46170 (11)	0.0394 (5)
N1A	0.6791 (2)	0.2101 (6)	0.39888 (13)	0.0427 (7)
C2A	0.6607 (2)	0.0205 (7)	0.43824 (16)	0.0408 (8)
H2A	0.7142	−0.0786	0.4532	0.049*
N3A	0.5680 (2)	−0.0455 (6)	0.45958 (13)	0.0373 (6)
C4A	0.4828 (2)	0.0850 (6)	0.44094 (14)	0.0337 (7)
C4AA	0.4994 (2)	0.3010 (6)	0.39636 (14)	0.0338 (7)
C5A	0.4197 (2)	0.4509 (6)	0.37325 (14)	0.0361 (7)
H5A	0.3555	0.4132	0.3867	0.043*
C6A	0.4353 (2)	0.6566 (7)	0.33025 (15)	0.0368 (7)
C7A	0.5343 (3)	0.7079 (7)	0.31113 (15)	0.0394 (8)
H7A	0.5464	0.8449	0.2827	0.047*
C8A	0.6122 (3)	0.5608 (7)	0.33352 (16)	0.0412 (8)
H8A	0.6763	0.5982	0.3198	0.049*
C8AA	0.5971 (3)	0.3541 (6)	0.37691 (15)	0.0364 (7)
N9A	0.3578 (3)	0.8001 (6)	0.30523 (15)	0.0469 (8)
O1B	0.53939 (17)	0.5050 (4)	0.53859 (12)	0.0403 (6)
N1B	0.2624 (2)	0.3084 (6)	0.60178 (14)	0.0451 (7)
C2B	0.2799 (2)	0.4952 (7)	0.56163 (16)	0.0430 (8)
H2B	0.2257	0.5891	0.5458	0.052*
N3B	0.3720 (2)	0.5655 (5)	0.54065 (13)	0.0385 (6)
C4B	0.4570 (3)	0.4384 (6)	0.55929 (14)	0.0332 (7)
C4AB	0.4421 (2)	0.2222 (6)	0.60434 (15)	0.0332 (7)
C5B	0.5223 (3)	0.0742 (6)	0.62695 (14)	0.0367 (7)
H5B	0.5863	0.1136	0.6134	0.044*
C6B	0.5075 (3)	−0.1315 (6)	0.66954 (15)	0.0371 (7)
C7B	0.4094 (3)	−0.1838 (7)	0.68957 (15)	0.0409 (8)
H7B	0.3983	−0.3203	0.7183	0.049*
C8B	0.3303 (3)	−0.0383 (7)	0.66766 (15)	0.0415 (8)
H8B	0.2666	−0.0768	0.6818	0.050*
C8AB	0.3444 (2)	0.1679 (6)	0.62419 (15)	0.0373 (7)
N9B	0.5875 (3)	−0.2736 (7)	0.69421 (15)	0.0470 (8)
H3A	0.560 (2)	−0.190 (7)	0.4877 (16)	0.039 (10)*
H3B	0.383 (3)	0.702 (7)	0.5125 (17)	0.059 (12)*
H9AA	0.373 (3)	0.957 (9)	0.2838 (19)	0.054 (12)*
H9BB	0.638 (3)	−0.297 (10)	0.667 (2)	0.071 (14)*
H9BA	0.571 (3)	−0.431 (9)	0.715 (2)	0.062 (12)*
H9AB	0.307 (3)	0.804 (8)	0.3255 (19)	0.050 (12)*