x	y	z	Uiso*/Ueq
Cl1	0.43755 (6)	1.38055 (4)	1.08930 (3)	0.03010 (15)
Cl2	0.12302 (6)	0.14811 (4)	0.23248 (3)	0.03132 (15)
O1	0.82246 (16)	1.34506 (11)	0.83292 (9)	0.0255 (3)
O2	−0.04349 (15)	0.18117 (10)	0.58032 (8)	0.0248 (3)
N1	0.55743 (18)	1.17733 (13)	0.80785 (10)	0.0223 (4)
N2	1.02695 (19)	1.32173 (13)	0.88624 (11)	0.0265 (4)
N3	0.59265 (18)	1.05244 (13)	0.69781 (10)	0.0245 (4)
N4	0.47574 (18)	0.86689 (13)	0.54748 (10)	0.0252 (4)
N5	0.05941 (18)	0.35809 (13)	0.53319 (10)	0.0224 (4)
N6	0.13408 (19)	0.17182 (13)	0.67722 (10)	0.0245 (4)
N7	0.10986 (18)	0.48198 (12)	0.67195 (10)	0.0221 (4)
N8	0.11770 (18)	0.67465 (12)	0.77966 (10)	0.0219 (4)
C1	0.6055 (2)	1.26737 (16)	0.88188 (12)	0.0217 (4)
C2	0.5157 (2)	1.27768 (16)	0.94409 (12)	0.0230 (4)
H2	0.4327	1.2217	0.9400	0.028*
C3	0.5486 (2)	1.36993 (16)	1.01146 (12)	0.0238 (5)
C4	0.6674 (2)	1.45349 (16)	1.01968 (13)	0.0279 (5)
H4	0.6862	1.5163	1.0654	0.034*
C5	0.7592 (2)	1.44418 (16)	0.95978 (13)	0.0276 (5)
H5	0.8423	1.5005	0.9646	0.033*
C6	0.7283 (2)	1.35212 (16)	0.89302 (12)	0.0230 (4)
C7	0.8879 (2)	1.28001 (16)	0.84410 (12)	0.0228 (4)
C8	1.0898 (2)	1.25901 (17)	0.89859 (13)	0.0280 (5)
H8	1.1890	1.2871	0.9293	0.034*
C9	1.0194 (2)	1.15579 (17)	0.86940 (12)	0.0260 (5)
H9	1.0689	1.1145	0.8800	0.031*
C10	0.8740 (2)	1.11413 (16)	0.82406 (12)	0.0226 (4)
H10	0.8224	1.0436	0.8029	0.027*
C11	0.8060 (2)	1.17713 (15)	0.81026 (12)	0.0209 (4)
C12	0.6466 (2)	1.13941 (15)	0.77075 (12)	0.0208 (4)
C13	0.6737 (2)	1.03001 (16)	0.62703 (12)	0.0262 (5)
H13A	0.7797	1.0629	0.6530	0.031*
H13B	0.6506	1.0567	0.5804	0.031*
C14	0.4348 (2)	1.00197 (16)	0.66368 (14)	0.0295 (5)
H14A	0.4021	1.0285	0.6193	0.035*
H14B	0.3838	1.0148	0.7137	0.035*
C15	0.6332 (2)	0.91819 (16)	0.58523 (13)	0.0266 (5)
H15A	0.6870	0.9036	0.5370	0.032*
H15B	0.6617	0.8924	0.6313	0.032*
C16	0.3981 (2)	0.88978 (16)	0.61953 (13)	0.0277 (5)
H16A	0.4238	0.8630	0.6655	0.033*
H16B	0.2919	0.8558	0.5946	0.033*
C17	0.4348 (2)	0.75783 (16)	0.50652 (13)	0.0283 (5)
H17A	0.3273	0.7252	0.4932	0.034*
H17B	0.4753	0.7336	0.5502	0.034*
C18	0.4887 (3)	0.72652 (17)	0.42041 (14)	0.0345 (6)
H18A	0.4413	0.7450	0.3746	0.041*
H18B	0.5951	0.7634	0.4323	0.041*
C19	0.4567 (2)	0.61571 (17)	0.38432 (13)	0.0270 (5)
C20	0.5436 (2)	0.57522 (18)	0.42136 (13)	0.0321 (5)
H20	0.6227	0.6183	0.4708	0.039*
C21	0.5179 (3)	0.47376 (19)	0.38809 (15)	0.0398 (6)
H21	0.5809	0.4482	0.4133	0.048*
C22	0.4013 (3)	0.40982 (19)	0.31860 (17)	0.0458 (7)
H22	0.3828	0.3399	0.2961	0.055*
C23	0.3108 (3)	0.4477 (2)	0.28147 (15)	0.0447 (7)
H23	0.2294	0.4037	0.2338	0.054*
C24	0.3391 (2)	0.55034 (19)	0.31401 (14)	0.0367 (6)
H24	0.2773	0.5760	0.2878	0.044*
C25	0.0493 (2)	0.26283 (15)	0.47717 (12)	0.0209 (4)
C26	0.0878 (2)	0.25284 (16)	0.39394 (12)	0.0233 (4)
H26	0.1293	0.3107	0.3789	0.028*
C27	0.0653 (2)	0.15853 (16)	0.33345 (12)	0.0235 (5)
C28	0.0012 (2)	0.07163 (16)	0.35102 (13)	0.0251 (5)
H28	−0.0174	0.0076	0.3073	0.030*
C29	−0.0354 (2)	0.08040 (16)	0.43400 (12)	0.0238 (5)
H29	−0.0781	0.0221	0.4483	0.029*
C30	−0.0094 (2)	0.17435 (15)	0.49555 (12)	0.0226 (4)
C31	0.0867 (2)	0.22962 (16)	0.64466 (12)	0.0225 (4)
C32	0.2615 (2)	0.21837 (17)	0.73820 (13)	0.0273 (5)
H32	0.2987	0.1789	0.7629	0.033*
C33	0.3407 (2)	0.32015 (16)	0.76676 (12)	0.0244 (5)
H33	0.4299	0.3497	0.8100	0.029*
C34	0.2875 (2)	0.37851 (16)	0.73110 (12)	0.0222 (4)
H34	0.3399	0.4488	0.7495	0.027*
C35	0.1563 (2)	0.33270 (15)	0.66807 (12)	0.0205 (4)
C36	0.0998 (2)	0.38808 (15)	0.62012 (12)	0.0211 (4)
C37	0.0757 (2)	0.50015 (15)	0.76178 (12)	0.0235 (5)
H37A	0.1046	0.4567	0.7895	0.028*
H37B	−0.0305	0.4830	0.7564	0.028*
C38	0.0800 (2)	0.54901 (15)	0.62959 (12)	0.0246 (5)
H38A	−0.0260	0.5346	0.6170	0.029*
H38B	0.1126	0.5384	0.5720	0.029*
C39	0.1557 (2)	0.60878 (15)	0.82070 (12)	0.0238 (5)
H39A	0.1299	0.6206	0.8803	0.029*
H39B	0.2621	0.6246	0.8295	0.029*
C40	0.1610 (2)	0.65674 (15)	0.69272 (12)	0.0230 (4)
H40A	0.2672	0.6715	0.7023	0.028*
H40B	0.1406	0.7027	0.6649	0.028*
C41	0.1924 (2)	0.78003 (15)	0.83789 (12)	0.0251 (5)
H41A	0.1826	0.8231	0.8035	0.030*
H41B	0.2974	0.7935	0.8554	0.030*
C42	0.1336 (2)	0.80871 (16)	0.92268 (13)	0.0273 (5)
H42A	0.0302	0.7997	0.9056	0.033*
H42B	0.1379	0.7633	0.9556	0.033*
C43	0.2189 (2)	0.91604 (16)	0.98384 (12)	0.0245 (5)
C44	0.3466 (2)	0.93923 (17)	1.04455 (13)	0.0263 (5)
H44	0.3809	0.8875	1.0460	0.032*
C45	0.4243 (2)	1.03739 (17)	1.10308 (13)	0.0286 (5)
H45	0.5102	1.0520	1.1449	0.034*
C46	0.3771 (2)	1.11341 (17)	1.10059 (13)	0.0313 (5)
H46	0.4300	1.1803	1.1407	0.038*
C47	0.2520 (2)	1.09162 (17)	1.03929 (13)	0.0302 (5)
H47	0.2199	1.1439	1.0366	0.036*
C48	0.1736 (2)	0.99370 (16)	0.98195 (13)	0.0279 (5)
H48	0.0873	0.9794	0.9406	0.033*