x	y	z	Uiso*/Ueq	Occ. (<1)
Mn1	0.61048 (5)	0.82243 (4)	0.74029 (4)	0.02005 (14)
Mn2	0.48190 (5)	0.66143 (4)	0.60353 (4)	0.01677 (13)
Mn3	0.68442 (4)	0.74479 (4)	0.31273 (4)	0.01583 (13)
Mn4	0.56057 (4)	0.57784 (4)	0.34706 (3)	0.01455 (13)
Mn5	0.10236 (4)	0.49328 (4)	0.28193 (4)	0.01948 (14)
Mn6	0.32112 (4)	0.55349 (4)	0.36584 (3)	0.01522 (13)
O1	0.5427 (2)	0.69222 (18)	0.72622 (16)	0.0195 (5)
O2	0.5479 (2)	0.79948 (18)	0.62323 (17)	0.0235 (6)
O3	0.6380 (2)	0.65305 (17)	0.62194 (16)	0.0174 (5)
C31	0.6579 (3)	0.6311 (2)	0.5602 (2)	0.0160 (7)
O4	0.3075 (2)	0.6456 (2)	0.55926 (19)	0.0259 (6)
H4D	0.279 (3)	0.631 (3)	0.5055 (13)	0.031*
H4E	0.310 (4)	0.696 (2)	0.578 (3)	0.031*
O5	0.4100 (2)	0.52276 (17)	0.59896 (16)	0.0156 (5)
H5D	0.365 (3)	0.495 (3)	0.5456 (14)	0.019*
O6	0.4395 (2)	0.64189 (17)	0.47837 (16)	0.0157 (5)
H6D	0.500 (2)	0.658 (3)	0.481 (3)	0.019*
O7	0.5504 (2)	0.68689 (17)	0.30572 (16)	0.0171 (5)
O8	0.6949 (2)	0.63902 (17)	0.34421 (17)	0.0180 (5)
O9	0.4763 (2)	0.46920 (19)	0.21367 (17)	0.0217 (6)
H9D	0.433 (3)	0.457 (3)	0.1600 (14)	0.026*
H9E	0.457 (3)	0.4095 (17)	0.221 (3)	0.026*
O10	0.62797 (19)	0.66251 (17)	0.48852 (16)	0.0161 (5)
O11	0.41448 (19)	0.52118 (17)	0.33573 (16)	0.0153 (5)
H11D	0.395 (3)	0.4645 (17)	0.344 (3)	0.018*
O12	0.3795 (2)	0.6940 (2)	0.31251 (18)	0.0225 (6)
H12C	0.431 (3)	0.695 (3)	0.306 (3)	0.027*
H12D	0.337 (3)	0.700 (3)	0.2668 (19)	0.027*
O13	0.2941 (2)	0.42210 (17)	0.43119 (16)	0.0168 (5)
O14	0.2164 (2)	0.56917 (18)	0.38531 (17)	0.0207 (6)
O15	0.1984 (2)	0.47938 (18)	0.25634 (16)	0.0186 (5)
N1	0.4899 (3)	0.8385 (2)	0.7517 (3)	0.0329 (9)
H1	0.4326	0.8173	0.6946	0.039*
N2	0.6871 (3)	0.8367 (2)	0.8772 (2)	0.0299 (8)
H2	0.7216	0.9024	0.9049	0.036*
N3	0.7501 (3)	0.8279 (2)	0.7488 (2)	0.0277 (8)
H3	0.7309	0.7636	0.7277	0.033*
N4	0.6771 (3)	0.9739 (2)	0.7492 (2)	0.0308 (8)
H4	0.7301	1.0060	0.8071	0.037*
N5	0.6293 (3)	0.6958 (2)	0.1816 (2)	0.0220 (7)
H5	0.6090	0.6294	0.1742	0.026*
N6	0.6648 (3)	0.8692 (2)	0.2847 (2)	0.0198 (7)
H6	0.7222	0.9115	0.2747	0.024*
N7	0.7583 (3)	0.8187 (2)	0.4409 (2)	0.0197 (7)
H7	0.7066	0.7878	0.4604	0.024*
N8	0.8384 (3)	0.7991 (2)	0.3170 (2)	0.0222 (7)
H8	0.8620	0.8644	0.3140	0.027*
N9	0.0652 (3)	0.3703 (2)	0.3302 (2)	0.0280 (8)
H9	0.1263	0.3867	0.3841	0.034*
N10	−0.0219 (3)	0.4080 (3)	0.1564 (2)	0.0276 (8)
H10	−0.0890	0.3919	0.1544	0.033*
N11	0.1099 (3)	0.6064 (3)	0.2213 (3)	0.0349 (9)
H11	0.1700	0.6246	0.2111	0.042*
N12	−0.0018 (3)	0.5104 (3)	0.3234 (3)	0.0381 (9)
H12	−0.0707	0.4860	0.2751	0.046*
C1	0.4406 (4)	0.7784 (4)	0.8054 (3)	0.0433 (12)
H1A	0.4079	0.7080	0.7793	0.052*
H1B	0.3815	0.7913	0.8033	0.052*
C2	0.5257 (5)	0.8021 (4)	0.9006 (4)	0.0575 (16)
H2A	0.5589	0.8729	0.9252	0.069*
H2B	0.4879	0.7665	0.9342	0.069*
C3	0.6154 (4)	0.7779 (4)	0.9158 (3)	0.0444 (13)
H3A	0.5829	0.7076	0.8898	0.053*
H3B	0.6608	0.7894	0.9801	0.053*
C4	0.7723 (4)	0.8054 (3)	0.8941 (3)	0.0413 (12)
H4A	0.7376	0.7333	0.8752	0.050*
H4B	0.8241	0.8252	0.9579	0.050*
C5	0.8319 (4)	0.8533 (4)	0.8431 (3)	0.0423 (12)
H5A	0.8724	0.9252	0.8659	0.051*
H5B	0.8852	0.8299	0.8494	0.051*
C6	0.7960 (4)	0.8854 (3)	0.6931 (3)	0.0396 (12)
H6A	0.7425	0.8548	0.6302	0.048*
H6B	0.8635	0.8823	0.7036	0.048*
C7	0.8227 (4)	0.9928 (3)	0.7118 (3)	0.0455 (14)
H7A	0.8752	1.0225	0.7750	0.055*
H7B	0.8593	1.0275	0.6772	0.055*
C8	0.7266 (5)	1.0086 (3)	0.6908 (3)	0.0465 (14)
H8A	0.7496	1.0794	0.6956	0.056*
H8B	0.6709	0.9741	0.6291	0.056*
C9	0.5843 (4)	0.9973 (3)	0.7282 (4)	0.0476 (14)
H9A	0.6131	1.0687	0.7463	0.057*
H9B	0.5341	0.9757	0.6640	0.057*
C10	0.5250 (4)	0.9442 (4)	0.7779 (4)	0.0535 (15)
H10A	0.5739	0.9690	0.8421	0.064*
H10B	0.4606	0.9543	0.7633	0.064*
C11	0.5300 (3)	0.7012 (3)	0.1180 (3)	0.0270 (9)
H11A	0.4682	0.6607	0.1297	0.032*
H11B	0.5108	0.6727	0.0575	0.032*
C12	0.5439 (3)	0.8035 (3)	0.1223 (3)	0.0275 (9)
H12A	0.4782	0.8016	0.0737	0.033*
H12B	0.6075	0.8445	0.1128	0.033*
C13	0.5608 (3)	0.8510 (3)	0.2084 (3)	0.0244 (8)
H13A	0.5596	0.9141	0.2030	0.029*
H13B	0.4991	0.8084	0.2195	0.029*
C14	0.6760 (3)	0.9175 (3)	0.3670 (3)	0.0234 (8)
H14A	0.6088	0.8804	0.3730	0.028*
H14B	0.6870	0.9849	0.3645	0.028*
C15	0.7724 (3)	0.9199 (3)	0.4441 (3)	0.0248 (9)
H15A	0.8407	0.9634	0.4417	0.030*
H15B	0.7774	0.9457	0.4998	0.030*
C16	0.8569 (3)	0.8134 (3)	0.5043 (3)	0.0246 (8)
H16A	0.8366	0.7444	0.5077	0.030*
H16B	0.8832	0.8512	0.5634	0.030*
C17	0.9504 (3)	0.8531 (3)	0.4794 (3)	0.0266 (9)
H17A	0.9682	0.9212	0.4734	0.032*
H17B	1.0160	0.8550	0.5280	0.032*
C18	0.9251 (3)	0.7943 (3)	0.3954 (3)	0.0247 (8)
H18A	0.9924	0.8187	0.3886	0.030*
H18B	0.9020	0.7251	0.3994	0.030*
C19	0.8205 (3)	0.7441 (3)	0.2352 (3)	0.0272 (9)
H19A	0.8085	0.6770	0.2407	0.033*
H19B	0.8856	0.7774	0.2255	0.033*
C20	0.7220 (3)	0.7402 (3)	0.1592 (3)	0.0296 (9)
H20A	0.7044	0.6997	0.1044	0.035*
H20B	0.7360	0.8068	0.1503	0.035*
C21	0.0490 (4)	0.2806 (3)	0.2803 (3)	0.0384 (11)
H21A	0.0326	0.2275	0.3118	0.046*
H21B	0.1180	0.2943	0.2790	0.046*
C22	−0.0434 (4)	0.2451 (3)	0.1854 (3)	0.0376 (11)
H22A	−0.0541	0.1822	0.1587	0.045*
H22B	−0.1121	0.2327	0.1867	0.045*
C23	−0.0229 (4)	0.3161 (3)	0.1279 (3)	0.0334 (10)
H23A	0.0483	0.3325	0.1298	0.040*
H23B	−0.0806	0.2846	0.0662	0.040*
C24	−0.0075 (4)	0.4717 (4)	0.0938 (3)	0.0409 (12)
H24A	−0.0740	0.4424	0.0360	0.049*
H24B	0.0553	0.4785	0.0852	0.049*
C25	0.0127 (4)	0.5694 (4)	0.1313 (4)	0.0518 (14)
H25A	−0.0522	0.5636	0.1357	0.062*
H25B	0.0279	0.6151	0.0932	0.062*
C26	0.1297 (4)	0.6964 (4)	0.2709 (4)	0.0506 (14)
H26A	0.1339	0.7455	0.2343	0.061*
H26B	0.2013	0.7233	0.3245	0.061*
C27	0.0424 (5)	0.6807 (4)	0.2976 (5)	0.0619 (17)
H27A	−0.0293	0.6516	0.2439	0.074*
H27B	0.0563	0.7453	0.3241	0.074*
C28	0.0351 (4)	0.6150 (4)	0.3628 (4)	0.0562 (16)
H28A	0.1078	0.6414	0.4151	0.067*
H28B	−0.0169	0.6162	0.3826	0.067*
C29	−0.0100 (4)	0.4490 (4)	0.3874 (3)	0.0488 (14)
H29A	−0.0731	0.4392	0.3969	0.059*
H29B	0.0573	0.4817	0.4446	0.059*
C30	−0.0244 (4)	0.3517 (4)	0.3525 (3)	0.0454 (13)
H30A	−0.0218	0.3122	0.3976	0.055*
H30B	−0.0962	0.3151	0.2994	0.055*
Cl1	0.91039 (8)	1.01855 (7)	0.29167 (7)	0.0268 (2)
Cl2	0.24589 (13)	0.79935 (12)	0.60522 (13)	0.0769 (6)
Cl3	0.86737 (18)	1.07361 (15)	0.96304 (14)	0.0367 (5)	0.50
Cl4	0.2516 (2)	0.7178 (3)	0.1287 (2)	0.0673 (10)	0.50
Cl5A	−0.2407 (3)	0.4394 (3)	0.1490 (3)	0.0730 (12)	0.40
Cl5B	−0.2790 (9)	0.2686 (11)	0.0485 (8)	0.045 (3)	0.10
Cl6	0.5772 (2)	0.49181 (16)	0.08903 (17)	0.0465 (6)	0.50
O16	0.2661 (3)	0.9080 (3)	0.7683 (3)	0.0518 (10)
O17	1.0355 (3)	1.1982 (3)	0.8871 (2)	0.0498 (9)
O18	−0.2086 (3)	0.6154 (3)	0.0340 (2)	0.0507 (9)
O19	0.8974 (3)	0.9445 (3)	0.1130 (3)	0.0585 (10)
O20	−0.2526 (7)	0.3240 (7)	0.1109 (6)	0.068 (2)*	0.50
O21A	0.2119 (5)	0.4846 (5)	0.6239 (4)	0.0420 (15)*	0.55
O21B	0.1753 (6)	0.4493 (6)	0.5731 (5)	0.0388 (17)*	0.45
O22A	0.4103 (9)	0.9540 (8)	0.9533 (7)	0.061 (3)*	0.45
O22B	0.3601 (10)	0.9330 (9)	0.9500 (8)	0.049 (3)*	0.35
O22C	0.3772 (14)	0.8915 (13)	0.9507 (11)	0.037 (4)*	0.20
O23A	0.2723 (4)	0.4768 (4)	0.1348 (4)	0.0357 (12)*	0.60
O23B	0.2584 (7)	0.4259 (7)	0.1386 (5)	0.0369 (19)*	0.40
O24A	0.4901 (5)	0.8550 (4)	0.4605 (4)	0.0360 (13)*	0.60
O24B	0.4420 (7)	0.8431 (6)	0.4547 (5)	0.0337 (19)*	0.40
O25A	0.6386 (9)	1.0576 (7)	0.4969 (6)	0.037 (2)*	0.35
O25B	0.5869 (11)	1.0364 (9)	0.4906 (8)	0.030 (3)*	0.25
O25C	0.7427 (14)	1.1185 (12)	0.5456 (11)	0.038 (4)*	0.20
O25D	0.7994 (10)	1.1247 (9)	0.5422 (8)	0.017 (3)*	0.20
O26A	0.3055 (10)	0.8377 (9)	0.0711 (8)	0.045 (3)*	0.31
O26B	0.3085 (13)	0.8749 (13)	0.0392 (11)	0.075 (5)*	0.30
O27	0.8491 (6)	1.1410 (5)	0.9027 (5)	0.0325 (16)*	0.42
O28	0.7746 (6)	1.0212 (6)	1.0010 (5)	0.0361 (18)*	0.40
O29	0.2422 (9)	0.6563 (8)	0.1076 (7)	0.049 (3)*	0.40
O30	0.2682 (14)	0.6482 (13)	0.0730 (12)	0.091 (5)*	0.33
O31	0.7693 (9)	0.4686 (9)	0.2254 (8)	0.054 (3)*	0.34