x	y	z	Uiso*/Ueq
Pt1	0.542736 (11)	0.577998 (8)	0.369297 (9)	0.01566 (5)
V1	0.30209 (5)	0.57189 (4)	0.38280 (4)	0.01817 (14)
V2	0.78344 (5)	0.58912 (4)	0.36257 (4)	0.02039 (14)
V3	0.77187 (5)	0.53187 (4)	0.16922 (4)	0.02286 (15)
V4	0.53009 (5)	0.52416 (3)	0.17333 (4)	0.01602 (13)
V5	0.29080 (5)	0.51648 (4)	0.18896 (4)	0.02100 (14)
V6	0.40522 (5)	0.66390 (4)	0.23543 (4)	0.01871 (14)
V7	0.64474 (5)	0.67109 (4)	0.22351 (4)	0.01951 (14)
V8	0.66979 (5)	0.44125 (3)	0.31842 (4)	0.01746 (14)
V9	0.42847 (5)	0.43285 (3)	0.32721 (4)	0.01673 (13)
O1	0.43349 (19)	0.54929 (14)	0.28217 (15)	0.0164 (5)
O2	0.63984 (19)	0.55714 (13)	0.27333 (16)	0.0162 (5)
O3	0.53101 (19)	0.67636 (13)	0.31501 (16)	0.0176 (5)
O4	0.55291 (18)	0.47198 (13)	0.39721 (16)	0.0148 (5)
O5	0.52143 (19)	0.62722 (14)	0.16275 (15)	0.0179 (5)
O6	0.54281 (19)	0.43699 (13)	0.23975 (16)	0.0170 (5)
O7	0.6651 (2)	0.60548 (16)	0.44559 (18)	0.0190 (6)
H7	0.683 (5)	0.582 (3)	0.481 (4)	0.06 (2)*
O8	0.4300 (2)	0.59913 (15)	0.45402 (18)	0.0175 (6)
H8	0.435 (6)	0.572 (4)	0.492 (5)	0.10 (3)*
O9	0.8507 (2)	0.56308 (15)	0.26057 (18)	0.0238 (6)
O10	0.6318 (2)	0.51241 (14)	0.10732 (16)	0.0203 (6)
O11	0.4210 (2)	0.50265 (14)	0.11669 (16)	0.0208 (6)
O12	0.22238 (19)	0.54062 (14)	0.28785 (17)	0.0200 (6)
O13	0.32205 (19)	0.66140 (14)	0.33012 (16)	0.0191 (6)
O14	0.3137 (2)	0.61527 (15)	0.16496 (17)	0.0217 (6)
O15	0.7300 (2)	0.63003 (15)	0.14740 (17)	0.0228 (6)
O16	0.7424 (2)	0.67589 (14)	0.31362 (17)	0.0214 (6)
O17	0.76362 (19)	0.48980 (14)	0.38500 (16)	0.0196 (6)
O18	0.7499 (2)	0.44365 (15)	0.21814 (17)	0.0228 (6)
O19	0.34106 (19)	0.47514 (14)	0.40544 (16)	0.0185 (5)
O20	0.3327 (2)	0.42802 (14)	0.23860 (17)	0.0206 (6)
O21	0.2156 (2)	0.58921 (15)	0.45354 (18)	0.0246 (6)
O22	0.8783 (2)	0.61015 (16)	0.42779 (18)	0.0266 (6)
O23	0.8536 (2)	0.51757 (17)	0.09315 (18)	0.0314 (7)
O24	0.2018 (2)	0.49432 (17)	0.12069 (19)	0.0316 (7)
O25	0.3944 (2)	0.74581 (15)	0.20034 (17)	0.0264 (6)
O26	0.6351 (2)	0.75336 (15)	0.18928 (18)	0.0262 (6)
O27	0.6792 (2)	0.35837 (15)	0.34966 (18)	0.0246 (6)
O28	0.4378 (2)	0.35126 (15)	0.36174 (18)	0.0244 (6)
C1	0.0305 (3)	0.4275 (2)	0.3703 (3)	0.0292 (10)
N1	−0.0557 (3)	0.3905 (2)	0.3781 (3)	0.0364 (9)
H1A	−0.0581	0.3449	0.3620	0.044*
H1B	−0.1112	0.4113	0.3994	0.044*
N2	0.1144 (3)	0.3970 (2)	0.3384 (3)	0.0491 (12)
H2A	0.1129	0.3514	0.3221	0.059*
H2B	0.1718	0.4223	0.3335	0.059*
N3	0.0348 (3)	0.4953 (2)	0.3973 (3)	0.0426 (10)
H3A	−0.0201	0.5155	0.4204	0.051*
H3B	0.0925	0.5202	0.3922	0.051*
C2	0.0401 (3)	0.6765 (2)	0.1762 (3)	0.0333 (10)
N4	−0.0499 (3)	0.7121 (2)	0.1651 (3)	0.0395 (10)
H4A	−0.1081	0.6928	0.1832	0.047*
H4B	−0.0507	0.7548	0.1397	0.047*
N5	0.1275 (3)	0.7054 (2)	0.1472 (3)	0.0427 (11)
H5A	0.1865	0.6819	0.1534	0.051*
H5B	0.1262	0.7482	0.1219	0.051*
N6	0.0416 (3)	0.6132 (2)	0.2138 (3)	0.0480 (12)
H6A	0.1005	0.5896	0.2201	0.058*
H6B	−0.0164	0.5942	0.2329	0.058*
C3	0.3111 (4)	0.3016 (2)	0.0616 (3)	0.0318 (10)
N7	0.2769 (3)	0.2520 (2)	0.0042 (2)	0.0444 (11)
H7A	0.2482	0.2120	0.0231	0.053*
H7B	0.2832	0.2595	−0.0526	0.053*
N8	0.3014 (3)	0.2900 (2)	0.1461 (2)	0.0404 (10)
H8A	0.3233	0.3225	0.1843	0.048*
H8B	0.2729	0.2497	0.1645	0.048*
N9	0.3535 (4)	0.3616 (2)	0.0331 (2)	0.0456 (11)
H9A	0.3757	0.3945	0.0707	0.055*
H9B	0.3597	0.3689	−0.0237	0.055*
C4	0.5247 (4)	0.8411 (3)	0.4233 (3)	0.0425 (12)
N10	0.4694 (4)	0.7839 (2)	0.4415 (3)	0.0556 (13)
H10A	0.4826	0.7424	0.4158	0.067*
H10B	0.4190	0.7869	0.4795	0.067*
N11	0.5065 (4)	0.9033 (3)	0.4640 (3)	0.0655 (16)
H11A	0.4573	0.9060	0.5031	0.079*
H11B	0.5437	0.9418	0.4518	0.079*
N12	0.6001 (4)	0.8374 (3)	0.3668 (3)	0.0661 (16)
H12A	0.6139	0.7961	0.3408	0.079*
H12B	0.6368	0.8761	0.3550	0.079*
C5	0.6277 (5)	0.3113 (3)	0.0507 (3)	0.0429 (13)
N13	0.6377 (4)	0.3018 (2)	0.1358 (3)	0.0543 (13)
H13A	0.6369	0.3392	0.1714	0.065*
H13B	0.6452	0.2579	0.1573	0.065*
N14	0.6164 (4)	0.3759 (2)	0.0178 (2)	0.0523 (13)
H14A	0.6154	0.4138	0.0528	0.063*
H14B	0.6097	0.3817	−0.0394	0.063*
N15	0.6325 (5)	0.2548 (2)	−0.0020 (3)	0.085 (2)
H15A	0.6281	0.2608	−0.0593	0.102*
H15B	0.6401	0.2112	0.0202	0.102*