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{
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{
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"structure_string": "Sr8 In4 F28\n1.0\n0.000000 5.490570 0.002264\n12.380367 0.000000 0.000000\n0.000000 -0.089167 -8.358019\nSr In F\n8 4 28\ndirect\n0.763681 0.278498 0.554656 Sr\n0.236318 0.778498 0.945344 Sr\n0.236319 0.721503 0.445344 Sr\n0.763681 0.221503 0.054656 Sr\n0.236634 0.062342 0.324982 Sr\n0.763366 0.562343 0.175019 Sr\n0.763366 0.937658 0.675019 Sr\n0.236634 0.437658 0.824982 Sr\n0.279970 0.124546 0.788230 In\n0.720029 0.624546 0.711771 In\n0.279971 0.375454 0.288230 In\n0.720029 0.875454 0.211771 In\n0.988293 0.755265 0.692757 F\n0.495827 0.103945 0.573993 F\n0.011706 0.244735 0.307243 F\n0.988294 0.744735 0.192757 F\n0.011706 0.255265 0.807243 F\n0.201721 0.543181 0.286617 F\n0.986920 0.895920 0.411032 F\n0.986920 0.604080 0.911032 F\n0.013079 0.104080 0.588968 F\n0.798279 0.043181 0.213383 F\n0.504172 0.603945 0.926008 F\n0.013079 0.395920 0.088968 F\n0.504172 0.896056 0.426008 F\n0.364097 0.927546 0.124674 F\n0.495907 0.271289 0.798853 F\n0.504092 0.771289 0.701148 F\n0.504092 0.728712 0.201148 F\n0.495907 0.228712 0.298853 F\n0.201721 0.956819 0.786617 F\n0.635903 0.427546 0.375326 F\n0.635903 0.072455 0.875326 F\n0.364096 0.572455 0.624674 F\n0.791202 0.641803 0.463354 F\n0.208798 0.141802 0.036647 F\n0.208797 0.358198 0.536647 F\n0.791202 0.858198 0.963354 F\n0.495828 0.396055 0.073993 F\n0.798279 0.456819 0.713383 F\n",
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{
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"structure_string": "As8 C8 F24\n1.0\n10.374939 -0.000000 -0.000000\n0.000000 10.374939 0.000000\n0.000000 -0.000000 6.207467\nAs C F\n8 8 24\ndirect\n0.340415 0.500000 0.926982 As\n0.659585 0.500000 0.926982 As\n0.000000 0.159585 0.426982 As\n0.000000 0.840415 0.426982 As\n0.840415 0.000000 0.573019 As\n0.159585 0.000000 0.573019 As\n0.500000 0.340415 0.073019 As\n0.500000 0.659585 0.073019 As\n0.500000 0.768795 0.798182 C\n0.500000 0.231205 0.798182 C\n0.731205 0.000000 0.298182 C\n0.268795 0.000000 0.298182 C\n0.000000 0.268795 0.701818 C\n0.768795 0.500000 0.201818 C\n0.231205 0.500000 0.201818 C\n0.000000 0.731205 0.701818 C\n0.653094 0.893970 0.294521 F\n0.153094 0.393970 0.205480 F\n0.846906 0.606030 0.205480 F\n0.606030 0.846906 0.794521 F\n0.393970 0.153094 0.794521 F\n0.653094 0.106030 0.294521 F\n0.346906 0.893970 0.294521 F\n0.393970 0.846906 0.794521 F\n0.606030 0.153094 0.794521 F\n0.346906 0.106030 0.294521 F\n0.893970 0.653094 0.705480 F\n0.000000 0.798851 0.890556 F\n0.846906 0.393970 0.205480 F\n0.153094 0.606030 0.205480 F\n0.500000 0.701149 0.609444 F\n0.500000 0.298851 0.609444 F\n0.201149 0.000000 0.109444 F\n0.798851 0.000000 0.109444 F\n0.893970 0.346906 0.705480 F\n0.000000 0.201149 0.890556 F\n0.701149 0.500000 0.390556 F\n0.298851 0.500000 0.390556 F\n0.106030 0.346906 0.705480 F\n0.106030 0.653094 0.705480 F\n",
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{
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"created_at": "2022-09-04T14:38:30.657752Z",
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"structure_string": "Na6 In4 P6 O24\n1.0\n6.382485 0.011830 -1.891717\n-2.748884 8.534764 -0.257511\n0.001991 -0.018999 8.970201\nNa In P O\n6 4 6 24\ndirect\n0.000000 0.500000 0.500000 Na\n0.750001 0.723471 0.276529 Na\n0.750000 0.014245 0.985754 Na\n0.500000 0.500000 0.500000 Na\n0.250001 0.985754 0.014246 Na\n0.250000 0.276529 0.723471 Na\n0.654911 0.070691 0.382094 In\n0.845090 0.617905 0.929309 In\n0.154911 0.382094 0.070691 In\n0.345090 0.929308 0.617906 In\n0.133603 0.136105 0.340081 P\n0.633603 0.340081 0.136105 P\n0.250000 0.725183 0.274817 P\n0.866398 0.863894 0.659919 P\n0.366398 0.659919 0.863895 P\n0.750000 0.274817 0.725183 P\n0.672267 0.934325 0.592243 O\n0.172266 0.592242 0.934326 O\n0.327734 0.065674 0.407757 O\n0.827735 0.407757 0.065674 O\n0.781935 0.260315 0.560872 O\n0.668119 0.439405 0.286795 O\n0.718066 0.439127 0.739685 O\n0.218066 0.739685 0.439128 O\n0.281935 0.560872 0.260315 O\n0.543862 0.154502 0.746327 O\n0.956139 0.253672 0.845498 O\n0.456139 0.845497 0.253673 O\n0.043862 0.746327 0.154502 O\n0.168118 0.286795 0.439405 O\n0.583068 0.666762 0.993525 O\n0.416933 0.333237 0.006475 O\n0.083068 0.993524 0.666763 O\n0.378392 0.834716 0.839217 O\n0.121609 0.160782 0.165283 O\n0.621609 0.165283 0.160782 O\n0.878392 0.839217 0.834717 O\n0.831882 0.713204 0.560595 O\n0.916933 0.006475 0.333237 O\n0.331882 0.560594 0.713204 O\n",
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{
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"structure_string": "Cu4 S16 Br4 N16\n1.0\n6.921146 -0.019023 0.000000\n-2.490589 8.800026 0.000000\n0.000000 0.000000 11.751153\nCu S Br N\n4 16 4 16\ndirect\n0.136738 0.421791 0.168116 Cu\n0.863263 0.578209 0.831884 Cu\n0.363262 0.578209 0.668116 Cu\n0.636738 0.421792 0.331884 Cu\n0.974790 0.698051 0.082212 S\n0.889094 0.767120 0.386516 S\n0.304306 0.004570 0.620825 S\n0.260650 0.144311 0.416448 S\n0.195694 0.995431 0.120825 S\n0.025211 0.301950 0.917788 S\n0.474789 0.698051 0.417788 S\n0.804306 0.004570 0.879174 S\n0.610907 0.232881 0.886516 S\n0.695695 0.995431 0.379175 S\n0.110907 0.232881 0.613483 S\n0.525211 0.301950 0.582212 S\n0.739351 0.855690 0.583551 S\n0.389093 0.767120 0.113483 S\n0.760651 0.144311 0.083551 S\n0.239350 0.855690 0.916448 S\n0.975688 0.389541 0.352966 Br\n0.475688 0.389541 0.147034 Br\n0.024313 0.610460 0.647034 Br\n0.524313 0.610460 0.852966 Br\n0.367421 0.922432 0.171553 N\n0.132580 0.077568 0.671553 N\n0.230537 0.008163 0.983734 N\n0.025491 0.727914 0.945181 N\n0.166265 0.642867 0.130624 N\n0.974510 0.272087 0.054819 N\n0.666266 0.642867 0.369376 N\n0.269464 0.991838 0.483734 N\n0.867421 0.922433 0.328446 N\n0.333735 0.357133 0.630624 N\n0.730537 0.008163 0.516266 N\n0.525491 0.727914 0.554819 N\n0.769464 0.991838 0.016266 N\n0.474509 0.272087 0.445181 N\n0.833735 0.357134 0.869376 N\n0.632580 0.077568 0.828446 N\n",
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{
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"structure_string": "Al6 Bi10 Br24\n1.0\n10.820129 0.111962 6.429685\n3.712224 10.164011 6.429685\n0.158338 0.111962 12.585347\nAl Bi Br\n6 10 24\ndirect\n0.769900 0.730100 0.250000 Al\n0.250000 0.769900 0.730100 Al\n0.230100 0.269900 0.750000 Al\n0.269900 0.750000 0.230100 Al\n0.730100 0.250000 0.769900 Al\n0.750000 0.230100 0.269900 Al\n0.250000 0.405321 0.094679 Bi\n0.094679 0.250000 0.405321 Bi\n0.405321 0.094679 0.250000 Bi\n0.750000 0.594678 0.905321 Bi\n0.327315 0.327314 0.327314 Bi\n0.594679 0.905321 0.750000 Bi\n0.827315 0.827314 0.827314 Bi\n0.672685 0.672685 0.672685 Bi\n0.172685 0.172685 0.172685 Bi\n0.905321 0.750000 0.594678 Bi\n0.309237 0.932317 0.039624 Br\n0.595648 0.771375 0.200561 Br\n0.799439 0.404352 0.228624 Br\n0.039625 0.309237 0.932318 Br\n0.690763 0.067682 0.960375 Br\n0.299439 0.728625 0.904352 Br\n0.190763 0.460375 0.567683 Br\n0.932318 0.039624 0.309237 Br\n0.904352 0.299439 0.728625 Br\n0.960375 0.690762 0.067682 Br\n0.728625 0.904352 0.299439 Br\n0.809237 0.539624 0.432317 Br\n0.567683 0.190762 0.460375 Br\n0.771375 0.200561 0.595648 Br\n0.700561 0.271375 0.095648 Br\n0.460375 0.567682 0.190762 Br\n0.539625 0.432317 0.809237 Br\n0.228625 0.799439 0.404352 Br\n0.432317 0.809237 0.539624 Br\n0.404352 0.228625 0.799439 Br\n0.067682 0.960375 0.690763 Br\n0.200561 0.595648 0.771375 Br\n0.095648 0.700561 0.271375 Br\n0.271375 0.095648 0.700561 Br\n",
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{
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"structure_string": "B4 H16 O8 F12\n1.0\n5.450083 0.000000 0.046970\n0.000000 7.260109 0.000000\n0.116340 0.000000 8.595550\nB H O F\n4 16 8 12\ndirect\n0.263625 0.305807 0.918625 B\n0.736375 0.805807 0.581375 B\n0.736375 0.694193 0.081375 B\n0.263625 0.194193 0.418625 B\n0.168277 0.936673 0.840873 H\n0.168277 0.563327 0.340873 H\n0.831722 0.063327 0.159127 H\n0.910783 0.225683 0.657817 H\n0.089217 0.725683 0.842183 H\n0.089217 0.774318 0.342183 H\n0.910783 0.274317 0.157817 H\n0.831722 0.436673 0.659127 H\n0.374845 0.739290 0.181773 H\n0.374845 0.760710 0.681773 H\n0.625154 0.260710 0.818227 H\n0.615562 0.282483 0.515193 H\n0.384437 0.782483 0.984807 H\n0.384437 0.717517 0.484807 H\n0.615562 0.217517 0.015193 H\n0.625154 0.239290 0.318228 H\n0.767502 0.308721 0.664468 O\n0.232498 0.808721 0.835532 O\n0.767502 0.191279 0.164468 O\n0.232498 0.691280 0.335532 O\n0.481991 0.772505 0.085691 O\n0.481991 0.727495 0.585691 O\n0.518008 0.227495 0.914309 O\n0.518008 0.272505 0.414309 O\n0.906348 0.841186 0.102809 F\n0.244663 0.431831 0.797070 F\n0.755337 0.931831 0.702930 F\n0.755337 0.568169 0.202930 F\n0.244663 0.068169 0.297070 F\n0.216433 0.385997 0.065163 F\n0.783567 0.885997 0.434837 F\n0.783567 0.614003 0.934837 F\n0.216433 0.114003 0.565163 F\n0.093651 0.158814 0.897191 F\n0.906348 0.658815 0.602809 F\n0.093651 0.341186 0.397191 F\n",
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{
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"structure_string": "Ba4 Cu4 Se8 O24\n1.0\n5.242411 0.000000 0.000000\n0.000000 9.002532 0.000000\n0.000000 0.000000 13.453695\nBa Cu Se O\n4 4 8 24\ndirect\n0.002871 0.754605 0.297987 Ba\n-0.002871 0.254605 0.202013 Ba\n0.002871 0.754605 0.702013 Ba\n-0.002871 0.254605 0.797986 Ba\n0.542148 0.045816 0.632403 Cu\n0.457852 0.545816 0.867596 Cu\n0.457852 0.545816 0.132403 Cu\n0.542148 0.045816 0.367597 Cu\n0.921809 0.659443 0.000000 Se\n0.494296 0.418283 0.637535 Se\n0.470130 0.728278 0.500000 Se\n0.494296 0.418283 0.362465 Se\n0.505704 0.918282 0.137535 Se\n0.505704 0.918282 0.862465 Se\n0.529870 0.228278 0.000000 Se\n0.078190 0.159443 0.500000 Se\n0.472018 0.240496 0.688901 O\n0.980938 0.065274 0.396838 O\n0.527982 0.740496 0.811098 O\n0.316136 0.504750 0.730177 O\n0.472018 0.240496 0.311099 O\n0.458527 0.332844 0.105217 O\n0.980938 0.065274 0.603162 O\n0.527982 0.740496 0.188901 O\n0.683863 0.004750 0.769822 O\n0.799134 0.466050 0.664751 O\n0.019061 0.565274 0.103162 O\n0.316136 0.504750 0.269822 O\n0.799134 0.466050 0.335248 O\n0.145794 0.723141 0.500000 O\n0.854206 0.223141 0.000000 O\n0.415060 0.108204 0.500000 O\n0.584939 0.608204 0.000000 O\n0.458527 0.332844 0.894783 O\n0.541473 0.832844 0.605217 O\n0.200866 0.966050 0.164751 O\n0.683863 0.004750 0.230177 O\n0.200866 0.966050 0.835248 O\n0.019061 0.565274 0.896838 O\n0.541473 0.832844 0.394783 O\n",
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