No title 1.0 7.76984868 0.00000000 0.00000000 0.13032753 24.44030431 0.00000000 0.04503821 -0.11094984 10.84033246 Si O Cl H F 40 16 4 13 2 Selective dynamics Direct 0.01487709 0.46782092 0.07953753 T T T # 1 Si1 0.99816233 0.54742093 0.44149635 T T T # 2 Si2 0.26768877 0.46748543 0.19977062 T T T # 3 Si3 0.24972588 0.55000419 0.31807565 T T T # 4 Si4 0.00016159 0.23765577 0.43226904 F F F # 5 Si5 0.25016159 0.23765577 0.31728364 F F F # 6 Si6 0.00016159 0.31057313 0.06288618 F F F # 7 Si7 0.25016159 0.31057313 0.18666650 F F F # 8 Si8 0.00016159 0.38707726 0.43649863 F F F # 9 Si9 0.25016159 0.38707726 0.31305405 F F F # 10 Si10 0.00335459 0.46707700 0.56034842 T T T # 11 Si11 0.00507301 0.55058152 0.95547867 T T T # 12 Si12 0.24903201 0.47019023 0.69442353 T T T # 13 Si13 0.24607745 0.55211957 0.82467542 T T T # 14 Si14 0.25016159 0.23765577 0.81728364 F F F # 15 Si15 0.00016159 0.31057313 0.56288618 F F F # 16 Si16 0.25016159 0.31057313 0.68666650 F F F # 17 Si17 0.00016159 0.38707726 0.93649863 F F F # 18 Si18 0.25016159 0.38707726 0.81305405 F F F # 19 Si19 0.50984687 0.46809074 0.06297091 T T T # 20 Si20 0.49750930 0.55996689 0.44534891 T T T # 21 Si21 0.74952582 0.46785861 0.20009545 T T T # 22 Si22 0.74729842 0.54976157 0.31849063 T T T # 23 Si23 0.50016159 0.23765577 0.43226904 F F F # 24 Si24 0.75016159 0.23765577 0.31728364 F F F # 25 Si25 0.50016159 0.31057313 0.06288618 F F F # 26 Si26 0.75016159 0.31057313 0.18666650 F F F # 27 Si27 0.50016159 0.38707726 0.43649863 F F F # 28 Si28 0.75016159 0.38707726 0.31305405 F F F # 29 Si29 0.49531646 0.47259598 0.55983862 T T T # 30 Si30 0.48368535 0.55352042 0.95735230 T T T # 31 Si31 0.74926075 0.46814915 0.68097531 T T T # 32 Si32 0.74427291 0.53468329 0.84784550 T T T # 33 Si33 0.50016159 0.23765577 0.93226904 F F F # 34 Si34 0.75016159 0.23765577 0.81728364 F F F # 35 Si35 0.75016159 0.31057313 0.68666650 F F F # 36 Si36 0.50016159 0.38707726 0.93649863 F F F # 37 Si37 0.75016159 0.38707726 0.81305405 F F F # 38 Si38 0.22799803 0.67826797 0.73720687 T T T # 39 Si39 0.50907706 0.68758873 0.50892381 T T T # 40 Si40 0.24903955 0.61025695 0.75072182 T T T # 41 O1 0.50369106 0.61853781 0.52489309 T T T # 42 O2 0.99344814 0.59470785 0.55111993 T T T # 43 O3 0.25055673 0.60114674 0.21615416 T T T # 44 O4 0.00673766 0.60517662 0.05010912 T T T # 45 O5 0.75860065 0.60029814 0.21442975 T T T # 46 O6 0.49735031 0.60645275 0.05476969 T T T # 47 O7 0.71875636 0.47673709 0.93819519 T T T # 48 O8 0.27752312 0.68346803 0.58794018 T T T # 49 O9 0.00236711 0.18062629 0.52813471 T T T # 50 O10 0.25680945 0.17766605 0.24035260 T T T # 51 O11 0.24117604 0.17955320 0.73189392 T T T # 52 O12 0.51638923 0.19539991 0.54877752 T T T # 53 O13 0.73700124 0.18182472 0.22100953 T T T # 54 O14 0.48815878 0.18197282 0.02553470 T T T # 55 O15 0.80595824 0.17638330 0.76468851 T T T # 56 O16 0.40180536 0.71260167 0.85703291 T T T # 57 Cl1 0.41538636 0.71199174 0.34131525 T T T # 58 Cl2 0.98668730 0.70210531 0.79806495 T T T # 59 Cl3 0.78878774 0.69337132 0.47340912 T T T # 60 Cl4 0.92684941 0.62826958 0.53291434 T T T # 61 H1 0.14984773 0.60510526 0.15790362 T T T # 62 H2 0.90580029 0.60711668 0.10966586 T T T # 63 H3 0.65559806 0.60589064 0.15954580 T T T # 64 H4 0.39920439 0.60929959 0.11708757 T T T # 65 H5 0.82444044 0.45346130 0.94429574 T T T # 66 H6 0.02168302 0.14561182 0.48618778 T T T # 67 H7 0.32312106 0.17631380 0.16209040 T T T # 68 H8 0.14772393 0.17836692 0.67021270 T T T # 69 H9 0.42116410 0.18842235 0.60750747 T T T # 70 H10 0.76146515 0.14590164 0.25478844 T T T # 71 H11 0.58757104 0.17786439 0.08143336 T T T # 72 H12 0.85308951 0.17435098 0.68033736 T T T # 73 H13 0.53646574 0.73677790 0.60683787 T T T # 74 F1 0.21589163 0.75965115 0.62709897 T T T # 75 F2