x	y	z	Uiso*/Ueq	Occ. (<1)
C1	0.4968 (4)	0.63319 (16)	0.71887 (18)	0.0419 (8)
H1	0.436429	0.642234	0.688364	0.050*
C2	0.4754 (4)	0.59200 (17)	0.75643 (18)	0.0447 (9)
H2	0.400029	0.574379	0.751734	0.054*
C3	0.5613 (4)	0.57648 (15)	0.79997 (17)	0.0401 (8)
C4	0.6716 (3)	0.60482 (14)	0.80685 (16)	0.0366 (7)
C5	0.6857 (3)	0.64682 (14)	0.76893 (15)	0.0337 (7)
C6	0.7914 (3)	0.67862 (14)	0.77523 (15)	0.0330 (7)
C7	0.8836 (3)	0.66881 (14)	0.81965 (15)	0.0344 (7)
C8	0.9882 (3)	0.70185 (15)	0.82297 (16)	0.0372 (8)
C9	0.9894 (3)	0.74058 (15)	0.78113 (17)	0.0392 (8)
H9	1.057717	0.762959	0.781641	0.047*
C10	0.8936 (3)	0.74789 (15)	0.73821 (16)	0.0371 (8)
H10	0.898217	0.775162	0.710376	0.044*
C11	0.7676 (4)	0.59493 (15)	0.85110 (17)	0.0420 (8)
H11	0.760653	0.566427	0.877238	0.050*
C12	0.8689 (4)	0.62497 (15)	0.85710 (17)	0.0410 (8)
H12	0.931331	0.616638	0.886880	0.049*
C13	0.5409 (4)	0.53348 (16)	0.84122 (18)	0.0430 (9)
C14	0.6087 (4)	0.48711 (17)	0.84560 (19)	0.0476 (9)
H14	0.666919	0.481392	0.819985	0.057*
C15	0.5927 (4)	0.44903 (19)	0.8869 (2)	0.0558 (11)
H15	0.638969	0.417219	0.889383	0.067*
C16	0.5082 (5)	0.4578 (2)	0.9246 (2)	0.0623 (13)
H16	0.497500	0.432103	0.953341	0.075*
C17	0.4402 (5)	0.5034 (2)	0.9205 (2)	0.0612 (13)
H17	0.383720	0.509189	0.946977	0.073*
C18	0.4524 (4)	0.54113 (19)	0.8785 (2)	0.0530 (10)
H18	0.402162	0.571714	0.874737	0.064*
C19	1.0915 (3)	0.69433 (15)	0.86768 (17)	0.0398 (8)
C20	1.2076 (4)	0.69364 (18)	0.8510 (2)	0.0498 (10)
H20	1.218902	0.698542	0.811734	0.060*
C21	1.3058 (4)	0.6857 (2)	0.8924 (2)	0.0597 (12)
H21	1.384291	0.685222	0.881279	0.072*
C22	1.2903 (5)	0.67864 (19)	0.9492 (2)	0.0616 (13)
H22	1.357999	0.672767	0.977012	0.074*
C23	1.1762 (5)	0.68000 (18)	0.9662 (2)	0.0552 (11)
H23	1.166012	0.675357	1.005603	0.066*
C24	1.0770 (4)	0.68816 (16)	0.92563 (18)	0.0448 (9)
H24	0.999071	0.689531	0.937390	0.054*
C25	0.7630 (4)	0.78075 (15)	0.59100 (17)	0.0393 (8)
H25	0.776432	0.748309	0.571790	0.047*
C26	0.8000 (4)	0.82847 (17)	0.56893 (17)	0.0417 (8)
H26	0.836290	0.827849	0.534316	0.050*
C27	0.7860 (3)	0.87685 (16)	0.59549 (16)	0.0376 (8)
C28	0.7286 (3)	0.87611 (15)	0.64690 (15)	0.0355 (7)
C29	0.6894 (3)	0.82666 (15)	0.66521 (15)	0.0336 (7)
C30	0.6204 (3)	0.82295 (14)	0.71241 (15)	0.0336 (7)
C31	0.5873 (3)	0.86886 (15)	0.74036 (15)	0.0353 (7)
C32	0.5039 (3)	0.86268 (16)	0.78164 (16)	0.0385 (8)
C33	0.4640 (4)	0.81197 (18)	0.79079 (17)	0.0448 (9)
H33	0.406076	0.806748	0.816649	0.054*
C34	0.5064 (4)	0.76813 (17)	0.76310 (17)	0.0417 (8)
H34	0.479814	0.733505	0.772105	0.050*
C35	0.7016 (4)	0.92207 (16)	0.67916 (16)	0.0411 (8)
H35	0.732044	0.955821	0.669557	0.049*
C36	0.6333 (4)	0.91869 (15)	0.72329 (16)	0.0404 (8)
H36	0.615865	0.950239	0.743172	0.048*
C37	0.8235 (3)	0.92742 (16)	0.57065 (17)	0.0406 (8)
C38	0.7885 (4)	0.93826 (17)	0.51282 (18)	0.0452 (9)
H38	0.746110	0.912285	0.488768	0.054*
C39	0.8163 (5)	0.98768 (19)	0.4904 (2)	0.0546 (11)
H39	0.791980	0.995228	0.450898	0.066*
C40	0.8775 (5)	1.0252 (2)	0.5241 (2)	0.0642 (13)
H40	0.893511	1.059098	0.508530	0.077*
C41	0.9166 (5)	1.0136 (2)	0.5815 (2)	0.0694 (14)
H41	0.961487	1.039373	0.604837	0.083*
C42	0.8908 (4)	0.9650 (2)	0.6047 (2)	0.0553 (11)
H42	0.918661	0.957125	0.643728	0.066*
C43	0.4570 (4)	0.91008 (17)	0.80923 (17)	0.0438 (9)
C44	0.5344 (4)	0.94603 (19)	0.84093 (18)	0.0497 (10)
H44	0.617986	0.938852	0.847674	0.060*
C45	0.4885 (5)	0.9920 (2)	0.8623 (2)	0.0669 (14)
H45	0.540387	1.015941	0.884830	0.080*
C46	0.3678 (6)	1.0033 (2)	0.8512 (3)	0.0749 (16)
H46	0.337699	1.035581	0.865191	0.090*
C47	0.2904 (5)	0.9684 (3)	0.8202 (3)	0.0775 (17)
H47	0.207405	0.976544	0.812452	0.093*
C48	0.3352 (4)	0.9214 (2)	0.8003 (2)	0.0599 (12)
H48	0.281748	0.896444	0.780217	0.072*
C49	0.8241 (3)	0.64466 (15)	0.63394 (16)	0.0369 (8)
H49	0.883090	0.655760	0.664172	0.044*
C50	0.8531 (3)	0.60596 (15)	0.59594 (16)	0.0370 (8)
H50	0.931940	0.591600	0.600143	0.044*
C51	0.7700 (3)	0.58771 (14)	0.55201 (15)	0.0328 (7)
C52	0.6528 (3)	0.61036 (14)	0.54691 (15)	0.0316 (7)
C53	0.6319 (3)	0.64999 (13)	0.58581 (15)	0.0308 (7)
C54	0.5186 (3)	0.67625 (14)	0.58226 (15)	0.0327 (7)
C55	0.4255 (3)	0.66234 (14)	0.53978 (15)	0.0329 (7)
C56	0.3169 (3)	0.69295 (15)	0.53654 (17)	0.0373 (8)
C57	0.3126 (4)	0.73284 (17)	0.57683 (19)	0.0442 (9)
H57	0.242483	0.754196	0.575696	0.053*
C58	0.4091 (3)	0.74269 (16)	0.61940 (18)	0.0424 (9)
H58	0.401972	0.770082	0.646843	0.051*
C59	0.5533 (3)	0.59306 (15)	0.50671 (16)	0.0357 (7)
H59	0.563429	0.563724	0.482060	0.043*
C60	0.4445 (3)	0.61795 (15)	0.50324 (16)	0.0354 (7)
H60	0.380459	0.605677	0.476192	0.042*
C61	0.8004 (3)	0.54451 (15)	0.51347 (16)	0.0358 (7)
C62	0.8472 (3)	0.49669 (16)	0.53789 (18)	0.0410 (8)
H62	0.861949	0.493119	0.578564	0.049*
C63	0.8717 (4)	0.45475 (17)	0.5028 (2)	0.0485 (10)
H63	0.902871	0.422302	0.519458	0.058*
C64	0.8514 (4)	0.45979 (19)	0.4442 (2)	0.0509 (10)
H64	0.864681	0.430264	0.420356	0.061*
C65	0.8114 (4)	0.5080 (2)	0.41955 (19)	0.0542 (11)
H65	0.802035	0.512000	0.378877	0.065*
C66	0.7852 (4)	0.55008 (18)	0.45419 (17)	0.0453 (9)
H66	0.756653	0.582820	0.437249	0.054*
C67	0.2124 (3)	0.68412 (15)	0.49285 (18)	0.0393 (8)
C68	0.2249 (4)	0.67567 (16)	0.43524 (18)	0.0425 (8)
H68	0.302622	0.674836	0.423196	0.051*
C69	0.1243 (4)	0.66842 (18)	0.3950 (2)	0.0515 (10)
H69	0.133435	0.662434	0.355684	0.062*
C70	0.0104 (4)	0.66996 (19)	0.4125 (2)	0.0551 (11)
H70	−0.058344	0.664926	0.385150	0.066*
C71	−0.0030 (4)	0.67879 (17)	0.4697 (2)	0.0536 (11)
H71	−0.081008	0.680011	0.481433	0.064*
C72	0.0967 (3)	0.68585 (16)	0.5098 (2)	0.0453 (9)
H72	0.086903	0.691887	0.549084	0.054*
Co1	0.65174 (5)	0.71899 (2)	0.67893 (2)	0.03151 (17)
N1	0.6003 (3)	0.66029 (12)	0.72480 (13)	0.0348 (6)
N2	0.7953 (3)	0.71751 (11)	0.73518 (13)	0.0333 (6)
N3	0.7088 (3)	0.77952 (12)	0.63882 (13)	0.0343 (6)
N4	0.5829 (3)	0.77309 (12)	0.72446 (13)	0.0350 (6)
N5	0.7153 (3)	0.66689 (12)	0.62928 (13)	0.0317 (6)
N6	0.5105 (3)	0.71465 (12)	0.62244 (14)	0.0356 (6)
F1	0.7023 (3)	0.70768 (14)	0.47885 (13)	0.0702 (8)
F2	0.5998 (3)	0.78510 (16)	0.47147 (16)	0.0821 (10)
F3	0.7786 (3)	0.77811 (14)	0.43789 (14)	0.0705 (9)
F4	0.6076 (3)	0.78566 (14)	0.37517 (14)	0.0766 (10)
F5	0.7095 (3)	0.70887 (17)	0.38305 (15)	0.0810 (10)
F6	0.5304 (3)	0.71560 (14)	0.41707 (13)	0.0715 (9)
P1	0.65426 (9)	0.74674 (5)	0.42702 (5)	0.0482 (3)
F7	0.1732 (3)	0.82570 (15)	0.72944 (19)	0.0954 (12)
F8	0.1590 (2)	0.90313 (11)	0.67956 (13)	0.0646 (8)
F9	−0.0012 (2)	0.84994 (12)	0.68175 (14)	0.0641 (7)
F10	0.0829 (4)	0.85907 (17)	0.60049 (16)	0.0907 (11)
F11	0.0985 (3)	0.78177 (13)	0.6499 (2)	0.0893 (12)
F12	0.2617 (3)	0.83455 (14)	0.6485 (2)	0.1071 (14)
P2	0.12975 (10)	0.84315 (5)	0.66478 (6)	0.0546 (3)
F13	0.0178 (3)	0.52703 (16)	0.67741 (13)	0.0883 (10)
F14	0.1488 (5)	0.5855 (2)	0.7846 (2)	0.1456 (16)
F15A	−0.0113 (13)	0.5394 (7)	0.7751 (6)	0.118 (3)	0.303 (5)
F15B	0.0464 (8)	0.5084 (3)	0.7714 (3)	0.1140 (18)	0.697 (5)
F16A	0.1522 (16)	0.5012 (5)	0.7440 (7)	0.121 (2)	0.303 (5)
F16B	0.2034 (5)	0.5305 (3)	0.7229 (3)	0.1017 (16)	0.697 (5)
F17A	0.1890 (11)	0.5803 (7)	0.6993 (6)	0.118 (3)	0.303 (5)
F17B	0.1091 (8)	0.6030 (3)	0.6892 (3)	0.1148 (18)	0.697 (5)
F18A	0.0146 (12)	0.6121 (4)	0.7185 (5)	0.113 (2)	0.303 (5)
F18B	−0.0489 (6)	0.5801 (3)	0.7374 (3)	0.1184 (18)	0.697 (5)
P3	0.08027 (17)	0.55560 (6)	0.73172 (6)	0.0755 (5)
O1	0.2529 (5)	0.6951 (3)	0.7055 (3)	0.1140 (19)
H1A	0.235 (8)	0.666 (2)	0.722 (4)	0.171*
H1B	0.186 (5)	0.705 (4)	0.685 (4)	0.171*