x	y	z	Uiso*/Ueq	Occ. (<1)
O1	0.83664 (7)	0.63481 (14)	0.38179 (2)	0.02938 (18)
H1O	0.7755 (17)	0.562 (4)	0.3786 (5)	0.068 (6)*
N1	0.75396 (7)	0.93228 (16)	0.42788 (2)	0.02387 (19)
H1N	0.7600 (11)	0.774 (3)	0.4290 (3)	0.031 (4)*
C1	0.82855 (8)	1.01229 (19)	0.40524 (3)	0.0256 (2)
H1A	0.8989	0.9969	0.4152	0.031*
H1B	0.8163	1.1769	0.4003	0.031*
C2	0.81900 (8)	0.87226 (18)	0.37442 (3)	0.0252 (2)
H2	0.7481	0.8905	0.3644	0.030*
C3	0.89639 (9)	0.9587 (2)	0.35095 (3)	0.0293 (2)
H3A	0.8870	1.1266	0.3481	0.035*
H3B	0.9665	0.9334	0.3606	0.035*
C4	0.88794 (9)	0.8449 (2)	0.31835 (3)	0.0291 (2)
C5	0.81775 (9)	0.9285 (2)	0.29442 (3)	0.0325 (3)
C6	0.81180 (9)	0.8239 (2)	0.26423 (3)	0.0360 (3)
H6	0.7642	0.8817	0.2481	0.043*
C7	0.87307 (10)	0.6384 (2)	0.25699 (3)	0.0363 (3)
C8	0.94234 (10)	0.5581 (2)	0.28094 (3)	0.0359 (3)
H8	0.9851	0.4314	0.2764	0.043*
C9	0.95115 (9)	0.6570 (2)	0.31138 (3)	0.0322 (3)
C10	0.74982 (11)	1.1329 (2)	0.30008 (3)	0.0393 (3)
H10A	0.7097	1.1034	0.3188	0.059*
H10B	0.7033	1.1580	0.2811	0.059*
H10C	0.7924	1.2700	0.3040	0.059*
C11	0.86603 (12)	0.5272 (3)	0.22430 (3)	0.0462 (3)
H11A	0.8362	0.3732	0.2259	0.069*
H11B	0.9348	0.5150	0.2162	0.069*
H11C	0.8225	0.6210	0.2095	0.069*
C12	1.03108 (10)	0.5649 (3)	0.33569 (3)	0.0400 (3)
H12A	1.0620	0.4256	0.3272	0.060*
H12B	0.9987	0.5279	0.3557	0.060*
H12C	1.0843	0.6814	0.3400	0.060*
C13	0.76617 (8)	1.02608 (19)	0.46103 (3)	0.0247 (2)
C14	0.86787 (9)	0.9562 (2)	0.47850 (3)	0.0336 (3)
H14A	0.8726	0.7880	0.4794	0.050*
H14B	0.8710	1.0182	0.5004	0.050*
H14C	0.9250	1.0176	0.4669	0.050*
C15	0.67782 (9)	0.9273 (2)	0.47916 (3)	0.0288 (2)
H15A	0.6125	0.9847	0.4695	0.043*
H15B	0.6853	0.9748	0.5017	0.043*
H15C	0.6790	0.7589	0.4779	0.043*
C16	0.75688 (10)	1.2882 (2)	0.45967 (3)	0.0306 (2)
H16A	0.8151	1.3522	0.4488	0.046*
H16B	0.7568	1.3497	0.4815	0.046*
H16C	0.6928	1.3306	0.4478	0.046*
O2	0.57184 (6)	1.06462 (16)	0.39828 (2)	0.0352 (2)
H2O	0.6278 (15)	1.004 (3)	0.4093 (5)	0.062 (5)*
N2	0.50806 (8)	0.78162 (18)	0.34494 (2)	0.0306 (2)
H2N	0.5598 (13)	0.887 (3)	0.3424 (4)	0.047 (4)*
C17	0.43655 (8)	0.8875 (2)	0.36627 (3)	0.0283 (2)
H17A	0.3746	0.7901	0.3671	0.034*
H17B	0.4151	1.0399	0.3577	0.034*
C18	0.48579 (8)	0.91565 (19)	0.39983 (3)	0.0264 (2)
H18	0.5096	0.7620	0.4081	0.032*
C19	0.41002 (9)	1.01744 (19)	0.42282 (3)	0.0271 (2)
H19A	0.4465	1.0414	0.4440	0.032*
H19B	0.3876	1.1702	0.4146	0.032*
C20	0.31558 (8)	0.87209 (19)	0.42747 (2)	0.0244 (2)
C21	0.32295 (8)	0.67813 (19)	0.44783 (2)	0.0246 (2)
C22	0.23623 (9)	0.5454 (2)	0.45241 (3)	0.0269 (2)
H22	0.2424	0.4139	0.4659	0.032*
C23	0.14096 (9)	0.5996 (2)	0.43785 (3)	0.0286 (2)
C24	0.13486 (8)	0.7904 (2)	0.41774 (3)	0.0287 (2)
H24	0.0704	0.8298	0.4075	0.034*
C25	0.21998 (9)	0.92618 (19)	0.41200 (3)	0.0264 (2)
C26	0.42242 (9)	0.6101 (2)	0.46563 (3)	0.0288 (2)
H26A	0.4727	0.5667	0.4502	0.043*
H26B	0.4103	0.4793	0.4797	0.043*
H26C	0.4488	0.7403	0.4785	0.043*
C27	0.04768 (9)	0.4554 (2)	0.44353 (3)	0.0369 (3)
H27A	0.0240	0.4888	0.4649	0.055*
H27B	0.0654	0.2920	0.4422	0.055*
H27C	−0.0070	0.4917	0.4272	0.055*
C28	0.20503 (9)	1.1238 (2)	0.38851 (3)	0.0317 (2)
H28A	0.2394	1.2613	0.3974	0.047*
H28B	0.1316	1.1549	0.3847	0.047*
H28C	0.2344	1.0828	0.3682	0.047*
C29	0.46433 (9)	0.7090 (2)	0.31290 (3)	0.0363 (3)
C30	0.5508 (4)	0.5955 (11)	0.29559 (17)	0.074 (2)	0.65 (3)
H30A	0.6091	0.7013	0.2952	0.111*	0.65 (3)
H30B	0.5266	0.5583	0.2735	0.111*	0.65 (3)
H30C	0.5722	0.4540	0.3069	0.111*	0.65 (3)
C31	0.3778 (4)	0.5356 (8)	0.31656 (15)	0.0441 (12)	0.65 (3)
H31A	0.3992	0.4212	0.3329	0.066*	0.65 (3)
H31B	0.3621	0.4583	0.2960	0.066*	0.65 (3)
H31C	0.3166	0.6162	0.3232	0.066*	0.65 (3)
C32	0.4236 (5)	0.9172 (8)	0.29385 (14)	0.0441 (12)	0.65 (3)
H32A	0.3700	0.9927	0.3055	0.066*	0.65 (3)
H32B	0.3950	0.8668	0.2728	0.066*	0.65 (3)
H32C	0.4797	1.0258	0.2910	0.066*	0.65 (3)
C30'	0.5561 (7)	0.632 (3)	0.2945 (2)	0.071 (4)	0.35 (3)
H30D	0.5967	0.7664	0.2891	0.107*	0.35 (3)
H30E	0.5317	0.5529	0.2748	0.107*	0.35 (3)
H30F	0.5987	0.5265	0.3079	0.107*	0.35 (3)
C31'	0.3957 (13)	0.503 (2)	0.3189 (3)	0.088 (5)	0.35 (3)
H31D	0.4373	0.3773	0.3285	0.132*	0.35 (3)
H31E	0.3625	0.4508	0.2985	0.132*	0.35 (3)
H31F	0.3432	0.5472	0.3336	0.132*	0.35 (3)
C32'	0.4036 (12)	0.891 (2)	0.2936 (3)	0.044 (2)	0.35 (3)
H32D	0.3457	0.9426	0.3057	0.066*	0.35 (3)
H32E	0.3779	0.8259	0.2731	0.066*	0.35 (3)
H32F	0.4482	1.0228	0.2897	0.066*	0.35 (3)
O3	0.6489 (2)	0.4428 (10)	0.3681 (3)	0.0388 (14)	0.59 (3)
O3'	0.6420 (5)	0.4819 (13)	0.3828 (5)	0.044 (3)	0.41 (3)
H3C	0.6156 (16)	0.335 (4)	0.3812 (5)	0.072 (6)*
H3D	0.5940 (18)	0.556 (4)	0.3639 (6)	0.083 (7)*