No title 1.0 7.76984869 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 0.01605706 0.46753769 0.07815101 T T T # 1 Si1 0.00021563 0.54692488 0.44171005 T T T # 2 Si2 0.26713608 0.46737485 0.19891122 T T T # 3 Si3 0.25098799 0.54986813 0.31834419 T T T # 4 Si4 0.00022623 0.23787307 0.43217957 F F F # 5 Si5 0.25022623 0.23787307 0.31719417 F F F # 6 Si6 0.00022623 0.31079043 0.06279671 F F F # 7 Si7 0.25022623 0.31079043 0.18657703 F F F # 8 Si8 0.00022623 0.38729456 0.43640916 F F F # 9 Si9 0.25022623 0.38729456 0.31296458 F F F # 10 Si10 0.00440671 0.46706720 0.56109248 T T T # 11 Si11 0.00624417 0.54994412 0.95642657 T T T # 12 Si12 0.25048754 0.47145508 0.69418740 T T T # 13 Si13 0.24534519 0.55281257 0.82590160 T T T # 14 Si14 0.25022623 0.23787307 0.81719417 F F F # 15 Si15 0.00022623 0.31079043 0.56279671 F F F # 16 Si16 0.25022623 0.31079043 0.68657703 F F F # 17 Si17 0.00022623 0.38729456 0.93640916 F F F # 18 Si18 0.25022623 0.38729456 0.81296458 F F F # 19 Si19 0.50931628 0.46824682 0.06300449 T T T # 20 Si20 0.50314832 0.55805461 0.44144717 T T T # 21 Si21 0.75224310 0.46716086 0.19744587 T T T # 22 Si22 0.75138616 0.54815824 0.31642181 T T T # 23 Si23 0.50022623 0.23787307 0.43217957 F F F # 24 Si24 0.75022623 0.23787307 0.31719417 F F F # 25 Si25 0.50022623 0.31079043 0.06279671 F F F # 26 Si26 0.75022623 0.31079043 0.18657703 F F F # 27 Si27 0.50022623 0.38729456 0.43640916 F F F # 28 Si28 0.75022623 0.38729456 0.31296458 F F F # 29 Si29 0.49695356 0.47228531 0.56055137 T T T # 30 Si30 0.48490266 0.55367077 0.95622844 T T T # 31 Si31 0.75034232 0.46824264 0.68093599 T T T # 32 Si32 0.74652328 0.53474022 0.84751089 T T T # 33 Si33 0.50022623 0.23787307 0.93217957 F F F # 34 Si34 0.75022623 0.23787307 0.81719417 F F F # 35 Si35 0.75022623 0.31079043 0.68657703 F F F # 36 Si36 0.50022623 0.38729456 0.93640916 F F F # 37 Si37 0.75022623 0.38729456 0.81296458 F F F # 38 Si38 0.20405403 0.67862019 0.76961422 T T T # 39 Si39 0.56682499 0.68460408 0.48012536 T T T # 40 Si40 0.24246124 0.61399660 0.75700903 T T T # 41 O1 0.52245355 0.62132637 0.51508483 T T T # 42 O2 0.99407803 0.59422054 0.55409089 T T T # 43 O3 0.25177611 0.60203482 0.21725214 T T T # 44 O4 0.00830126 0.60542558 0.05024643 T T T # 45 O5 0.75953033 0.60049686 0.21466774 T T T # 46 O6 0.49958766 0.60682026 0.05481671 T T T # 47 O7 0.71874635 0.47721584 0.93799063 T T T # 48 O8 0.22782024 0.69183958 0.61532099 T T T # 49 O9 0.00224664 0.18079744 0.52831440 T T T # 50 O10 0.25678095 0.17775265 0.24015073 T T T # 51 O11 0.24137245 0.17973650 0.73139124 T T T # 52 O12 0.51647314 0.19566350 0.54898598 T T T # 53 O13 0.73737650 0.18196944 0.22055614 T T T # 54 O14 0.48844627 0.18208371 0.02546843 T T T # 55 O15 0.80558083 0.17647652 0.76424844 T T T # 56 O16 0.35703297 0.71351432 0.89992540 T T T # 57 Cl1 0.42180235 0.71159102 0.33742893 T T T # 58 Cl2 0.95926613 0.70093409 0.81162742 T T T # 59 Cl3 0.82184595 0.69399940 0.43205388 T T T # 60 Cl4 0.94039528 0.62885166 0.53102267 T T T # 61 H1 0.15180117 0.60485063 0.15807662 T T T # 62 H2 0.90778152 0.60686889 0.11025481 T T T # 63 H3 0.65724223 0.60449460 0.15830123 T T T # 64 H4 0.40160094 0.60913591 0.11723673 T T T # 65 H5 0.82377010 0.45358458 0.94407769 T T T # 66 H6 0.02194479 0.14597843 0.48574077 T T T # 67 H7 0.32299990 0.17675443 0.16183655 T T T # 68 H8 0.14776937 0.17877724 0.66981664 T T T # 69 H9 0.42099391 0.18896036 0.60767127 T T T # 70 H10 0.76064515 0.14617447 0.25523533 T T T # 71 H11 0.58782852 0.17827921 0.08153236 T T T # 72 H12 0.85299935 0.17478729 0.67996195 T T T # 73 H13 0.55455492 0.72742789 0.59307631 T T T # 74 F1 0.17195965 0.75202172 0.61204174 T T T # 75 F2