x	y	z	Uiso*/Ueq	Occ. (<1)
O1A	0.06660 (12)	0.70857 (4)	0.28122 (10)	0.0543 (4)
O2A	0.03780 (11)	0.68796 (4)	0.40019 (10)	0.0477 (4)
O3A	0.11234 (9)	0.62090 (3)	0.40908 (7)	0.0296 (3)
O4A	0.21360 (12)	0.56043 (3)	0.37863 (10)	0.0491 (4)
O5A	0.39119 (12)	0.56511 (4)	0.39119 (12)	0.0636 (5)
O6A	0.55513 (10)	0.65993 (4)	0.25325 (8)	0.0417 (3)
O7A	0.46158 (11)	0.70758 (4)	0.23205 (9)	0.0446 (3)
N1A	0.09133 (12)	0.68950 (4)	0.33963 (10)	0.0329 (3)
N2A	0.29916 (12)	0.57781 (4)	0.37670 (9)	0.0321 (3)
N3A	0.47021 (12)	0.67773 (4)	0.25701 (9)	0.0318 (3)
C1A	0.27832 (13)	0.68191 (4)	0.29857 (10)	0.0259 (3)
H1A	0.2729	0.7046	0.2761	0.031*
C2A	0.19050 (12)	0.66773 (4)	0.33624 (10)	0.0245 (3)
C3A	0.18956 (12)	0.63312 (4)	0.37119 (9)	0.0224 (3)
C4A	0.29093 (13)	0.61429 (4)	0.35572 (9)	0.0246 (3)
C5A	0.38185 (13)	0.62869 (4)	0.32185 (9)	0.0260 (3)
H5A	0.4482	0.6155	0.3178	0.031*
C6A	0.37572 (13)	0.66236 (4)	0.29393 (9)	0.0260 (3)
O1B	0.41038 (10)	0.62930 (3)	0.10159 (8)	0.0377 (3)
O2B	0.50153 (9)	0.58259 (3)	0.13563 (9)	0.0385 (3)
O3B	0.37850 (9)	0.52841 (3)	0.06265 (7)	0.0261 (2)
O4B	0.25989 (12)	0.47144 (3)	0.10774 (9)	0.0432 (3)
O5B	0.08374 (12)	0.48134 (4)	0.08146 (10)	0.0571 (4)
O6B	−0.05515 (10)	0.58211 (4)	0.20725 (8)	0.0392 (3)
O7B	0.04050 (10)	0.62992 (3)	0.20991 (8)	0.0386 (3)
N1B	0.02960 (11)	0.59876 (4)	0.19519 (8)	0.0299 (3)
N2B	0.17976 (12)	0.49122 (4)	0.10008 (9)	0.0331 (3)
N3B	0.41401 (11)	0.59841 (3)	0.11880 (8)	0.0243 (3)
C1B	0.22192 (12)	0.59790 (4)	0.15207 (9)	0.0232 (3)
H1B	0.2297	0.6219	0.1648	0.028*
C2B	0.12167 (13)	0.58070 (4)	0.16165 (9)	0.0255 (3)
C3B	0.10926 (13)	0.54597 (4)	0.14262 (9)	0.0253 (3)
H3B	0.0402	0.5345	0.1490	0.030*
C4B	0.19756 (13)	0.52809 (4)	0.11443 (9)	0.0249 (3)
C5B	0.30432 (12)	0.54352 (4)	0.09843 (9)	0.0209 (3)
C6B	0.30933 (12)	0.57958 (4)	0.12386 (9)	0.0214 (3)
O1C	0.93330 (11)	0.49777 (4)	0.71717 (9)	0.0459 (3)
O2C	0.95844 (11)	0.51289 (4)	0.59358 (10)	0.0504 (4)
O3C	0.85836 (9)	0.57635 (3)	0.56438 (7)	0.0274 (2)
O4C	0.70931 (11)	0.63065 (3)	0.55889 (8)	0.0392 (3)
O5C	0.54488 (11)	0.60950 (4)	0.52653 (10)	0.0488 (4)
O6C	0.42608 (9)	0.52706 (3)	0.72080 (8)	0.0357 (3)
O7C	0.53457 (10)	0.48321 (3)	0.75141 (8)	0.0400 (3)
N1C	0.90358 (11)	0.51276 (4)	0.65333 (9)	0.0307 (3)
N2C	0.64000 (12)	0.60737 (4)	0.56060 (9)	0.0306 (3)
N3C	0.51685 (11)	0.51198 (4)	0.72106 (8)	0.0287 (3)
C1C	0.71259 (13)	0.51435 (4)	0.68752 (9)	0.0237 (3)
H1C	0.7274	0.4937	0.7180	0.028*
C2C	0.79609 (12)	0.53034 (4)	0.64799 (9)	0.0230 (3)
C3C	0.78325 (12)	0.56224 (4)	0.60164 (9)	0.0217 (3)
C4C	0.67031 (13)	0.57559 (4)	0.60354 (9)	0.0243 (3)
C5C	0.58477 (13)	0.55929 (4)	0.63995 (9)	0.0255 (3)
H5C	0.5116	0.5689	0.6361	0.031*
C6C	0.60648 (12)	0.52896 (4)	0.68195 (9)	0.0241 (3)
O1D	0.43842 (13)	0.41609 (4)	0.17945 (13)	0.0753 (6)
O2D	0.45803 (12)	0.38759 (4)	0.06991 (9)	0.0483 (4)
O3D	0.39104 (9)	0.32112 (3)	0.09394 (8)	0.0321 (3)
O4D	0.27366 (16)	0.26401 (4)	0.11869 (13)	0.0756 (6)
O5D	0.1088 (5)	0.2689 (2)	0.132 (2)	0.074 (6)	0.53 (5)
O5DA	0.1161 (9)	0.2685 (2)	0.1739 (14)	0.051 (3)	0.47 (5)
O6D	−0.04727 (10)	0.37181 (4)	0.23998 (8)	0.0417 (3)
O7D	0.04676 (10)	0.41989 (3)	0.24429 (8)	0.0392 (3)
N1D	0.41073 (12)	0.39325 (4)	0.13245 (10)	0.0335 (3)
N2D	0.19780 (13)	0.28171 (4)	0.13810 (9)	0.0346 (3)
N3D	0.03733 (11)	0.38876 (4)	0.22938 (8)	0.0310 (3)
C1D	0.22787 (13)	0.38939 (4)	0.18260 (10)	0.0259 (3)
H1D	0.2349	0.4132	0.1972	0.031*
C2D	0.31297 (13)	0.37241 (4)	0.14767 (10)	0.0246 (3)
C3D	0.31268 (12)	0.33593 (4)	0.12588 (9)	0.0237 (3)
C4D	0.21039 (13)	0.31897 (4)	0.14756 (9)	0.0258 (3)
C5D	0.12236 (13)	0.33613 (4)	0.17907 (10)	0.0271 (3)
H5D	0.0559	0.3239	0.1889	0.033*
C6D	0.13078 (13)	0.37097 (4)	0.19620 (10)	0.0266 (3)
O1E	0.08024 (11)	0.32801 (3)	0.38651 (11)	0.0522 (4)
O2E	0.00509 (10)	0.27786 (3)	0.36309 (9)	0.0387 (3)
O3E	0.14077 (9)	0.23016 (3)	0.45016 (7)	0.0273 (2)
O4E	0.28681 (12)	0.17609 (3)	0.42987 (9)	0.0453 (3)
O5E	0.45292 (11)	0.19515 (4)	0.46414 (11)	0.0559 (4)
O6E	0.56176 (10)	0.29016 (4)	0.29897 (8)	0.0429 (3)
O7E	0.45539 (11)	0.33582 (4)	0.29169 (8)	0.0457 (3)
N1E	0.08694 (11)	0.29654 (3)	0.37717 (8)	0.0274 (3)
N2E	0.35637 (12)	0.19938 (4)	0.43450 (10)	0.0344 (3)
N3E	0.47330 (12)	0.30510 (4)	0.30897 (8)	0.0337 (3)
C1E	0.28020 (13)	0.30019 (4)	0.34811 (9)	0.0261 (3)
H1E	0.2658	0.3233	0.3298	0.031*
C2E	0.19720 (12)	0.28065 (4)	0.37890 (9)	0.0236 (3)
C3E	0.21231 (12)	0.24610 (4)	0.41326 (9)	0.0221 (3)
C4E	0.32526 (13)	0.23366 (4)	0.40462 (10)	0.0249 (3)
C5E	0.40861 (13)	0.25255 (4)	0.37280 (9)	0.0265 (3)
H5E	0.4814	0.2430	0.3705	0.032*
C6E	0.38536 (13)	0.28565 (4)	0.34421 (9)	0.0270 (3)
N4A	0.75790 (11)	0.09105 (3)	0.43652 (9)	0.0303 (3)
N5A	0.69358 (11)	0.14260 (3)	0.39781 (8)	0.0244 (3)
N6A	0.90342 (12)	0.23186 (3)	0.47233 (9)	0.0253 (3)
H6AA	0.9724 (18)	0.2348 (5)	0.4655 (12)	0.032 (5)*
H6AB	0.8939 (15)	0.2239 (5)	0.5237 (13)	0.030 (5)*
H6AC	0.8659 (16)	0.2535 (5)	0.4655 (12)	0.034 (5)*
C7A	0.66412 (14)	0.09844 (4)	0.47645 (10)	0.0295 (3)
H7A	0.6323	0.0835	0.5146	0.035*
C8A	0.77269 (13)	0.11818 (4)	0.38983 (11)	0.0276 (3)
H8A	0.8319	0.1203	0.3547	0.033*
C9A	0.62334 (13)	0.13017 (4)	0.45358 (10)	0.0279 (3)
H9A	0.5595	0.1414	0.4723	0.033*
C10A	0.68255 (14)	0.17569 (4)	0.35409 (10)	0.0284 (3)
H10A	0.6025	0.1801	0.3383	0.034*
H10B	0.7224	0.1742	0.3035	0.034*
C11A	0.72981 (13)	0.20599 (4)	0.40554 (11)	0.0271 (3)
H11A	0.7011	0.2281	0.3812	0.033*
H11B	0.7038	0.2042	0.4612	0.033*
C12A	0.85708 (13)	0.20646 (4)	0.41082 (11)	0.0277 (3)
H12A	0.8856	0.1830	0.4255	0.033*
H12B	0.8830	0.2125	0.3567	0.033*
N4B	0.73741 (12)	0.39002 (3)	0.09045 (10)	0.0337 (3)
N5B	0.80676 (11)	0.44049 (3)	0.13254 (8)	0.0250 (3)
N6B	0.61280 (11)	0.53074 (3)	0.04321 (9)	0.0245 (3)
H6BA	0.6219 (15)	0.5212 (5)	−0.0074 (12)	0.029 (5)*
H6BB	0.5412 (18)	0.5353 (5)	0.0484 (12)	0.040 (6)*
H6BC	0.6517 (15)	0.5514 (5)	0.0468 (11)	0.029 (5)*
C7B	0.83655 (14)	0.39557 (4)	0.05633 (11)	0.0305 (4)
H7B	0.8699	0.3800	0.0204	0.037*
C8B	0.72217 (14)	0.41758 (4)	0.13569 (11)	0.0309 (4)
H8B	0.6592	0.4209	0.1668	0.037*
C9B	0.88023 (13)	0.42658 (4)	0.08124 (10)	0.0280 (3)
H9B	0.9481	0.4367	0.0662	0.034*
C10B	0.81931 (14)	0.47403 (4)	0.17389 (10)	0.0288 (3)
H10C	0.8990	0.4776	0.1924	0.035*
H10D	0.7757	0.4739	0.2228	0.035*
C11B	0.77981 (13)	0.50414 (4)	0.11863 (10)	0.0265 (3)
H11C	0.8114	0.5261	0.1416	0.032*
H11D	0.8080	0.5008	0.0640	0.032*
C12B	0.65295 (13)	0.50676 (4)	0.11003 (10)	0.0269 (3)
H12C	0.6209	0.4834	0.0989	0.032*
H12D	0.6260	0.5151	0.1621	0.032*
N4C	0.77635 (12)	0.29279 (3)	0.44507 (10)	0.0333 (3)
N5C	0.71008 (11)	0.34335 (3)	0.40054 (9)	0.0267 (3)
N6C	0.91077 (12)	0.43386 (3)	0.47087 (9)	0.0238 (3)
H6CA	0.9797 (17)	0.4372 (5)	0.4660 (11)	0.027 (5)*
H6CB	0.9011 (15)	0.4268 (5)	0.5215 (12)	0.026 (5)*
H6CC	0.8729 (16)	0.4547 (5)	0.4643 (12)	0.034 (5)*
C7C	0.68308 (15)	0.30101 (4)	0.48517 (11)	0.0326 (4)
H7C	0.6523	0.2870	0.5255	0.039*
C8C	0.64165 (14)	0.33207 (4)	0.45851 (11)	0.0310 (4)
H8C	0.5779	0.3437	0.4764	0.037*
C9C	0.78943 (14)	0.31884 (4)	0.39487 (11)	0.0302 (4)
H9C	0.8478	0.3202	0.3589	0.036*
C10C	0.69767 (14)	0.37533 (4)	0.35294 (11)	0.0300 (4)
H10E	0.6176	0.3788	0.3355	0.036*
H10F	0.7390	0.3730	0.3032	0.036*
C11C	0.74117 (13)	0.40700 (4)	0.40111 (11)	0.0278 (3)
H11E	0.7123	0.4283	0.3733	0.033*
H11F	0.7129	0.4064	0.4562	0.033*
C12C	0.86828 (13)	0.40808 (4)	0.40902 (10)	0.0273 (3)
H12E	0.8975	0.3848	0.4247	0.033*
H12F	0.8961	0.4141	0.3555	0.033*
N4D	0.22010 (12)	0.50702 (3)	0.56986 (9)	0.0317 (3)
N5D	0.28930 (11)	0.46050 (3)	0.63391 (8)	0.0258 (3)
N6D	0.11287 (12)	0.36876 (3)	0.55463 (9)	0.0233 (3)
H6DA	0.0399 (17)	0.3640 (5)	0.5526 (11)	0.029 (5)*
H6DB	0.1314 (16)	0.3766 (5)	0.5062 (13)	0.035 (5)*
H6DC	0.1483 (15)	0.3488 (5)	0.5657 (11)	0.028 (5)*
C7D	0.36432 (14)	0.47005 (4)	0.57872 (10)	0.0298 (3)
H7D	0.4329	0.4589	0.5693	0.036*
C8D	0.20416 (13)	0.48345 (4)	0.62573 (10)	0.0277 (3)
H8D	0.1403	0.4827	0.6567	0.033*
C9D	0.32091 (14)	0.49861 (4)	0.54037 (11)	0.0318 (4)
H9D	0.3553	0.5111	0.4990	0.038*
C10D	0.29807 (14)	0.43027 (4)	0.68810 (10)	0.0289 (3)
H10G	0.2483	0.4336	0.7330	0.035*
H10H	0.3758	0.4284	0.7126	0.035*
C11D	0.26634 (13)	0.39670 (4)	0.64306 (10)	0.0271 (3)
H11G	0.3086	0.3950	0.5937	0.033*
H11H	0.2875	0.3767	0.6787	0.033*
C12D	0.14198 (13)	0.39512 (4)	0.61840 (10)	0.0282 (3)
H12G	0.1013	0.3898	0.6672	0.034*
H12H	0.1167	0.4182	0.5979	0.034*
N4E	0.23642 (12)	0.30890 (4)	0.59484 (10)	0.0341 (3)
N5E	0.30112 (11)	0.26041 (3)	0.65175 (8)	0.0264 (3)
N6E	0.11830 (12)	0.17068 (3)	0.55652 (9)	0.0244 (3)
H6EA	0.0441 (19)	0.1656 (5)	0.5537 (13)	0.040 (6)*
H6EB	0.1349 (16)	0.1796 (5)	0.5102 (13)	0.031 (5)*
H6EC	0.1545 (17)	0.1495 (5)	0.5656 (12)	0.038 (5)*
C7E	0.34032 (15)	0.30216 (4)	0.56911 (11)	0.0334 (4)
H7E	0.3782	0.3163	0.5326	0.040*
C8E	0.21567 (14)	0.28319 (4)	0.64442 (11)	0.0308 (4)
H8E	0.1488	0.2810	0.6716	0.037*
C9E	0.38128 (14)	0.27238 (4)	0.60320 (11)	0.0314 (4)
H9E	0.4514	0.2619	0.5952	0.038*
C10E	0.30688 (15)	0.22809 (4)	0.69875 (10)	0.0309 (4)
H10I	0.2562	0.2298	0.7436	0.037*
H10J	0.3840	0.2249	0.7235	0.037*
C11E	0.27412 (14)	0.19658 (4)	0.64595 (11)	0.0289 (3)
H11I	0.3144	0.1974	0.5955	0.035*
H11J	0.2970	0.1751	0.6759	0.035*
C12E	0.14910 (13)	0.19551 (4)	0.62346 (10)	0.0285 (3)
H12I	0.1101	0.1889	0.6722	0.034*
H12J	0.1233	0.2190	0.6066	0.034*