No title 1.0 7.66310000 0.00000000 0.00000000 0.00000000 25.32620000 0.00000000 0.00000000 0.00000000 10.83726000 Si O Cl H N 40 14 5 15 1 Selective dynamics Direct 0.01872303 0.46127660 0.07494419 T T T # 1 Si1 0.00674819 0.54254730 0.43393755 T T T # 2 Si2 0.27031762 0.46365107 0.19465782 T T T # 3 Si3 0.26090797 0.54224466 0.31247790 T T T # 4 Si4 0.00181441 0.23760172 0.43215305 F F F # 5 Si5 0.25181441 0.23760172 0.31716765 F F F # 6 Si6 0.00181441 0.31051908 0.06277019 F F F # 7 Si7 0.25181441 0.31051908 0.18655051 F F F # 8 Si8 0.00181441 0.38702321 0.43638264 F F F # 9 Si9 0.25181441 0.38702321 0.31293806 F F F # 10 Si10 0.01030502 0.46473461 0.55537066 T T T # 11 Si11 0.01649891 0.54039774 0.95571437 T T T # 12 Si12 0.25500558 0.46869134 0.69076218 T T T # 13 Si13 0.23949920 0.55134860 0.81337305 T T T # 14 Si14 0.25181441 0.23760172 0.81716765 F F F # 15 Si15 0.00181441 0.31051908 0.56277019 F F F # 16 Si16 0.25181441 0.31051908 0.68655051 F F F # 17 Si17 0.00181441 0.38702321 0.93638264 F F F # 18 Si18 0.25181441 0.38702321 0.81293806 F F F # 19 Si19 0.50959793 0.46722247 0.05336452 T T T # 20 Si20 0.51373272 0.54492015 0.43457816 T T T # 21 Si21 0.75299357 0.46267587 0.19195791 T T T # 22 Si22 0.76016166 0.54040481 0.30650980 T T T # 23 Si23 0.50181441 0.23760172 0.43215305 F F F # 24 Si24 0.75181441 0.23760172 0.31716765 F F F # 25 Si25 0.50181441 0.31051908 0.06277019 F F F # 26 Si26 0.75181441 0.31051908 0.18655051 F F F # 27 Si27 0.50181441 0.38702321 0.43638264 F F F # 28 Si28 0.75181441 0.38702321 0.31293806 F F F # 29 Si29 0.50417181 0.46622424 0.55920848 T T T # 30 Si30 0.48709072 0.55280827 0.94034175 T T T # 31 Si31 0.75989780 0.46445850 0.67932206 T T T # 32 Si32 0.75409721 0.52961085 0.84276718 T T T # 33 Si33 0.50181441 0.23760172 0.93215305 F F F # 34 Si34 0.75181441 0.23760172 0.81716765 F F F # 35 Si35 0.75181441 0.31051908 0.68655051 F F F # 36 Si36 0.50181441 0.38702321 0.93638264 F F F # 37 Si37 0.75181441 0.38702321 0.81293806 F F F # 38 Si38 0.10801692 0.66789408 0.78647226 T T T # 39 Si39 0.52215224 0.66628549 0.48306517 T T T # 40 Si40 0.18799308 0.61010127 0.74212171 T T T # 41 O1 0.52340613 0.60213684 0.51251494 T T T # 42 O2 0.97983181 0.59275345 0.53054705 T T T # 43 O3 0.27289624 0.59515003 0.21619875 T T T # 44 O7 0.02785553 0.59144020 0.05480472 T T T # 45 O12 0.76786848 0.59049849 0.20316113 T T T # 46 O18 0.50978630 0.60356996 0.03855471 T T T # 47 O25 0.70800904 0.47386367 0.93235183 T T T # 48 O33 0.98570829 0.18391476 0.52931841 T T T # 49 O9 0.24763240 0.18372584 0.22034364 T T T # 50 O19 0.18132465 0.17773681 0.79070552 T T T # 51 O30 0.77963845 0.18273246 0.22981616 T T T # 52 O42 0.51217910 0.18514317 0.02952598 T T T # 53 O55 0.81978056 0.18131203 0.75294292 T T T # 54 O69 0.25728563 0.69965496 0.92234501 T T T # 55 Cl 0.74192293 0.68795969 0.38643404 T T T # 56 Cl4 0.85746461 0.65967272 0.85002141 T T T # 57 Cl2 0.53871282 0.70580095 0.64709044 T T T # 58 Cl3 0.08728608 0.71816235 0.64299666 T T T # 59 Cl5 0.07792722 0.60280323 0.58382993 T T T # 60 H11 0.17212042 0.59668355 0.15468818 T T T # 61 H19 0.92193324 0.59475212 0.11166987 T T T # 62 H28 0.66632643 0.59667482 0.14631978 T T T # 63 H38 0.41605008 0.60542314 0.10383827 T T T # 64 H49 0.81269776 0.45145988 0.95068520 T T T # 65 H61 0.30512102 0.72194012 0.39460102 T T T # 66 H9 0.30188453 0.66053421 0.33198872 T T T # 67 H21 0.99601370 0.14938639 0.49042616 T T T # 68 H12 0.13010726 0.17271433 0.19610172 T T T # 69 H24 0.05520472 0.17260261 0.77474851 T T T # 70 H37 0.69677875 0.17845561 0.16058544 T T T # 71 H51 0.41160830 0.18109898 0.08629524 T T T # 72 H66 0.85649322 0.18305912 0.66429519 T T T # 73 H82 0.31941868 0.77539127 0.33221308 T T T # 74 H15 0.33142026 0.68165489 0.41023596 T T T # 75 N1