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{
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{
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{
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"structure_string": "Al8 P8 H32 C8 N4 O32 F4\n1.0\n12.890899 0.000000 0.000000\n0.000000 8.689558 0.000000\n0.000000 3.722207 8.788170\nAl P H C N O F\n8 8 32 8 4 32 4\ndirect\n0.598425 0.090508 0.434812 Al\n0.098425 0.409492 0.565188 Al\n0.401575 0.909492 0.565188 Al\n0.901575 0.590508 0.434812 Al\n0.882653 0.319252 0.128279 Al\n0.382653 0.180748 0.871721 Al\n0.117347 0.680748 0.871721 Al\n0.617347 0.819252 0.128279 Al\n0.450453 0.018875 0.217100 P\n0.950453 0.481125 0.782900 P\n0.549547 0.981125 0.782900 P\n0.049547 0.518875 0.217100 P\n0.712561 0.454767 0.293616 P\n0.212561 0.045233 0.706384 P\n0.287439 0.545233 0.706384 P\n0.787439 0.954767 0.293616 P\n0.258219 0.410296 0.309438 H\n0.758219 0.089704 0.690562 H\n0.741781 0.589704 0.690562 H\n0.241781 0.910296 0.309438 H\n0.356901 0.272792 0.336988 H\n0.856901 0.227208 0.663012 H\n0.643099 0.727208 0.663012 H\n0.143099 0.772792 0.336988 H\n0.357755 0.591985 0.372690 H\n0.857755 0.908015 0.627310 H\n0.642245 0.408015 0.627310 H\n0.142245 0.091985 0.372690 H\n0.311526 0.437656 0.059708 H\n0.811526 0.062344 0.940292 H\n0.688474 0.562344 0.940292 H\n0.188474 0.937656 0.059708 H\n0.474407 0.510512 0.325094 H\n0.974407 0.989488 0.674906 H\n0.525593 0.489488 0.674906 H\n0.025593 0.010512 0.325094 H\n0.365558 0.610836 0.092288 H\n0.865558 0.889164 0.907712 H\n0.634442 0.389164 0.907712 H\n0.134442 0.110836 0.092288 H\n0.406814 0.391925 0.496484 H\n0.906814 0.108075 0.503516 H\n0.593186 0.608075 0.503516 H\n0.093186 0.891925 0.496484 H\n0.444322 0.432128 0.117035 H\n0.944322 0.067872 0.882965 H\n0.555678 0.567872 0.882965 H\n0.055678 0.932128 0.117035 H\n0.365962 0.474770 0.128142 C\n0.865962 0.025230 0.871858 C\n0.634038 0.525230 0.871858 C\n0.134038 0.974770 0.128142 C\n0.398211 0.479319 0.378667 C\n0.898211 0.020681 0.621333 C\n0.601789 0.520681 0.621333 C\n0.101789 0.979319 0.378667 C\n0.338029 0.398509 0.292521 N\n0.838029 0.101491 0.707479 N\n0.661971 0.601491 0.707479 N\n0.161971 0.898509 0.292521 N\n0.644159 0.304040 0.380044 O\n0.144159 0.195960 0.619956 O\n0.355841 0.695960 0.619956 O\n0.855841 0.804040 0.380044 O\n0.780236 0.496936 0.405684 O\n0.280236 0.003064 0.594316 O\n0.219764 0.503064 0.594316 O\n0.719764 0.996936 0.405684 O\n0.779460 0.424097 0.171987 O\n0.279460 0.075903 0.828013 O\n0.220540 0.575903 0.828013 O\n0.720540 0.924097 0.171987 O\n0.536950 0.127348 0.242471 O\n0.036950 0.372652 0.757529 O\n0.463050 0.872652 0.757529 O\n0.963050 0.627348 0.242471 O\n0.370083 0.961172 0.349337 O\n0.870083 0.538828 0.650663 O\n0.629917 0.038828 0.650663 O\n0.129917 0.461172 0.349337 O\n0.388030 0.120041 0.070588 O\n0.888030 0.379959 0.929412 O\n0.611970 0.879959 0.929412 O\n0.111970 0.620041 0.070588 O\n0.497986 0.864095 0.195482 O\n0.997986 0.635905 0.804518 O\n0.502014 0.135905 0.804518 O\n0.002014 0.364095 0.195482 O\n0.638866 0.602745 0.205545 O\n0.138866 0.897255 0.794455 O\n0.361134 0.397255 0.794455 O\n0.861134 0.102745 0.205545 O\n0.462348 0.130408 0.490421 F\n0.962348 0.369592 0.509579 F\n0.537652 0.869592 0.509579 F\n0.037652 0.630408 0.490421 F\n",
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{
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"structure_string": "Ba4 Mg6 F20\n1.0\n3.016340 9.371967 0.000000\n-3.016340 9.371967 0.000000\n0.000000 2.969602 7.350525\nBa Mg F\n4 6 20\ndirect\n0.283759 0.283759 0.315201 Ba\n0.716241 0.716241 0.684799 Ba\n0.386288 0.386288 0.719071 Ba\n0.613712 0.613712 0.280929 Ba\n0.074235 0.074235 0.545889 Mg\n0.925765 0.925765 0.454111 Mg\n0.177085 0.177085 0.985700 Mg\n0.822915 0.822915 0.014300 Mg\n0.746034 0.253966 0.000000 Mg\n0.253966 0.746034 0.000000 Mg\n0.857868 0.363691 0.975279 F\n0.636309 0.142132 0.024721 F\n0.142132 0.636309 0.024721 F\n0.363691 0.857868 0.975279 F\n0.910395 0.386486 0.525359 F\n0.613514 0.089605 0.474641 F\n0.089605 0.613514 0.474641 F\n0.386486 0.910395 0.525359 F\n0.022386 0.022386 0.818196 F\n0.977614 0.977614 0.181804 F\n0.134355 0.134355 0.256506 F\n0.865645 0.865645 0.743494 F\n0.236345 0.236345 0.722004 F\n0.763655 0.763655 0.277996 F\n0.517101 0.517101 0.820767 F\n0.482899 0.482899 0.179233 F\n0.781216 0.218784 0.500000 F\n0.218784 0.781216 0.500000 F\n0.000000 0.500000 0.000000 F\n0.500000 0.000000 0.000000 F\n",
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{
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"structure_string": "Na8 Be4 F16\n1.0\n8.106797 0.000000 0.000000\n0.000000 5.629743 0.000000\n0.000000 4.257219 7.904307\nNa Be F\n8 4 16\ndirect\n0.342984 0.411263 0.374711 Na\n0.842984 0.588737 0.125289 Na\n0.657016 0.588737 0.625289 Na\n0.157016 0.411263 0.874711 Na\n0.486500 0.144372 0.136733 Na\n0.986500 0.855628 0.363267 Na\n0.513500 0.855628 0.863267 Na\n0.013500 0.144372 0.636733 Na\n0.302925 0.753959 0.538144 Be\n0.697075 0.246041 0.461856 Be\n0.197075 0.753959 0.038144 Be\n0.802925 0.246041 0.961856 Be\n0.818454 0.484144 0.431921 F\n0.318454 0.515856 0.068079 F\n0.181546 0.515856 0.568079 F\n0.681546 0.484144 0.931921 F\n0.929928 0.212284 0.101496 F\n0.570072 0.212284 0.601496 F\n0.429928 0.787716 0.398504 F\n0.070072 0.787716 0.898504 F\n0.893039 0.323318 0.793114 F\n0.393039 0.676682 0.706886 F\n0.106961 0.676682 0.206886 F\n0.606961 0.323318 0.293114 F\n0.695078 0.984234 0.020344 F\n0.195078 0.015766 0.479656 F\n0.304922 0.015766 0.979656 F\n0.804922 0.984234 0.520344 F\n",
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{
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{
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{
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{
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