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{
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{
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{
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"structure_string": "Rb6 Mg6 Cl18\n1.0\n7.072239 -0.000000 -0.000000\n-3.536119 6.124739 0.000000\n0.000000 0.000000 17.574925\nRb Mg Cl\n6 6 18\ndirect\n0.666667 0.333333 0.587339 Rb\n0.666667 0.333333 0.912661 Rb\n0.333333 0.666667 0.412661 Rb\n0.000000 0.000000 0.250000 Rb\n0.000000 0.000000 0.750000 Rb\n0.333333 0.666667 0.087339 Rb\n0.000000 0.000000 0.000000 Mg\n0.666667 0.333333 0.160697 Mg\n0.333333 0.666667 0.839302 Mg\n0.666667 0.333333 0.339302 Mg\n0.333333 0.666667 0.660697 Mg\n0.000000 0.000000 0.500000 Mg\n0.834000 0.667999 0.081876 Cl\n0.987592 0.493795 0.250000 Cl\n0.834000 0.667999 0.418124 Cl\n0.493795 0.987592 0.750000 Cl\n0.667999 0.834000 0.581876 Cl\n0.166000 0.834000 0.918124 Cl\n0.166000 0.332001 0.918124 Cl\n0.166000 0.834000 0.581876 Cl\n0.332001 0.166000 0.418124 Cl\n0.332001 0.166000 0.081876 Cl\n0.834000 0.166000 0.081876 Cl\n0.667999 0.834000 0.918124 Cl\n0.506205 0.493795 0.250000 Cl\n0.493795 0.506205 0.750000 Cl\n0.506205 0.012409 0.250000 Cl\n0.834000 0.166000 0.418124 Cl\n0.166000 0.332001 0.581876 Cl\n0.012409 0.506205 0.750000 Cl\n",
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{
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"created_at": "2022-09-04T14:35:45.469848Z",
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"structure_string": "Mg6 Cr1 Co1\n1.0\n6.041803 0.013875 0.000000\n-3.008886 5.211543 0.000000\n0.000000 0.000000 4.780605\nMg Cr Co\n6 1 1\ndirect\n0.662718 0.331999 0.250000 Mg\n0.662717 0.830717 0.250000 Mg\n0.323006 0.167944 0.749999 Mg\n0.323006 0.655064 0.749999 Mg\n0.856833 0.178417 0.749999 Mg\n0.847308 0.673655 0.749999 Mg\n0.164332 0.832166 0.250000 Cr\n0.160077 0.330038 0.250000 Co\n",
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{
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"created_at": "2022-09-04T14:38:34.933511Z",
"updated_at": "2022-09-04T14:38:34.933534Z",
"structure_string": "K12 Mn2 Se8\n1.0\n5.110452 -8.851563 -0.000000\n5.110452 8.851563 0.000000\n0.000000 -0.000000 7.856003\nK Mn Se\n12 2 8\ndirect\n0.146582 0.853418 0.547116 K\n0.472838 0.527162 0.865778 K\n0.527162 0.054325 0.365778 K\n0.472838 0.945675 0.865778 K\n0.054325 0.527162 0.865778 K\n0.527162 0.472838 0.365778 K\n0.945675 0.472838 0.365778 K\n0.706837 0.853418 0.547116 K\n0.146582 0.293163 0.547116 K\n0.853418 0.706837 0.047116 K\n0.293163 0.146582 0.047116 K\n0.853418 0.146582 0.047116 K\n0.333333 0.666667 0.249895 Mn\n0.666667 0.333333 0.749895 Mn\n0.609781 0.804890 0.149140 Se\n0.333333 0.666667 0.576701 Se\n0.666667 0.333333 0.076701 Se\n0.195109 0.804890 0.149140 Se\n0.390219 0.195109 0.649139 Se\n0.804890 0.609781 0.649139 Se\n0.195109 0.390219 0.149140 Se\n0.804890 0.195109 0.649139 Se\n",
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{
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"created_at": "2022-09-04T14:38:50.505778Z",
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"structure_string": "Sc1 C1 Cl1\n1.0\n4.397438 -0.000000 -0.000000\n-2.198719 3.808293 -0.000000\n0.000000 0.000000 3.239604\nSc C Cl\n1 1 1\ndirect\n0.666668 0.333334 0.000000 Sc\n0.000000 0.000000 0.000000 C\n0.333334 0.666667 0.000000 Cl\n",
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{
"id": "jvasp-118558",
"created_at": "2022-09-04T14:38:51.821698Z",
"updated_at": "2022-09-04T14:38:51.821715Z",
"structure_string": "Li1 P1 I1\n1.0\n3.570780 0.000000 0.000000\n0.000000 3.570780 0.000000\n-0.000000 0.000000 7.588200\nLi P I\n1 1 1\ndirect\n0.000000 0.000000 0.688122 Li\n0.000000 0.000000 0.001606 P\n0.000000 0.000000 0.330859 I\n",
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{
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"created_at": "2022-09-04T14:38:14.836070Z",
"updated_at": "2022-09-04T14:38:14.836082Z",
"structure_string": "Si1 N2 F6\n1.0\n-3.682120 -3.682120 0.000000\n-3.682120 -0.000000 -3.682120\n0.000000 -3.682120 -3.682120\nSi N F\n1 2 6\ndirect\n0.000000 0.000000 0.000000 Si\n0.250000 0.250000 0.250000 N\n0.750000 0.750000 0.750000 N\n0.767707 0.232293 0.232293 F\n0.767707 0.232293 0.767707 F\n0.767707 0.767707 0.232293 F\n0.232293 0.767707 0.767707 F\n0.232293 0.767707 0.232293 F\n0.232293 0.232293 0.767707 F\n",
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{
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"created_at": "2022-09-04T14:38:43.454420Z",
"updated_at": "2022-09-04T14:38:43.454446Z",
"structure_string": "Cd1 H6 C5 O4\n1.0\n3.773974 0.128184 0.035178\n1.338979 4.250147 1.292811\n-0.303895 0.222087 9.038035\nCd H C O\n1 6 5 4\ndirect\n0.035000 0.548941 0.213347 Cd\n0.407147 0.389014 0.577814 H\n0.803504 0.484155 0.611424 H\n0.046988 0.878537 0.682446 H\n0.015720 0.538773 0.910105 H\n0.492257 0.810086 0.774382 H\n0.203306 0.249172 0.814603 H\n0.381074 0.847784 0.435894 C\n0.493823 0.584784 0.592670 C\n0.325407 0.693006 0.728336 C\n0.263753 0.423367 0.861333 C\n0.576728 0.239057 0.996417 C\n0.453183 0.768201 0.311725 O\n0.210909 0.134114 0.433432 O\n0.590817 0.360808 0.106891 O\n0.806868 0.970814 -0.003524 O\n",
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{
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"created_at": "2022-09-04T14:36:04.966345Z",
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"structure_string": "K16 Al16 O32\n1.0\n5.434692 0.000000 0.000000\n0.000000 10.914780 0.000000\n0.000000 0.000000 15.526966\nK Al O\n16 16 32\ndirect\n0.295483 0.261555 0.315228 K\n0.755144 0.010788 0.061679 K\n0.255144 0.489212 0.938321 K\n0.244856 0.510788 0.438321 K\n0.744856 0.989212 0.561679 K\n0.244856 0.989212 0.938321 K\n0.744856 0.510788 0.061679 K\n0.755144 0.489212 0.561679 K\n0.795483 0.238445 0.684773 K\n0.795483 0.261555 0.184773 K\n0.295483 0.238445 0.815228 K\n0.204516 0.761555 0.315228 K\n0.704516 0.738445 0.684773 K\n0.204516 0.738445 0.815228 K\n0.704516 0.761555 0.184773 K\n0.255144 0.010788 0.438321 K\n0.758322 0.492149 0.811317 Al\n0.741677 0.507851 0.311317 Al\n0.241677 0.992149 0.688683 Al\n0.741677 0.992149 0.811317 Al\n0.241677 0.507851 0.188683 Al\n0.258323 0.492149 0.688683 Al\n0.758322 0.007851 0.311317 Al\n0.719220 0.762432 0.436197 Al\n0.780779 0.237568 0.936197 Al\n0.219220 0.737568 0.563803 Al\n0.719220 0.737568 0.936197 Al\n0.219220 0.762432 0.063803 Al\n0.280780 0.237568 0.563803 Al\n0.258323 0.007851 0.188683 Al\n0.280780 0.262432 0.063803 Al\n0.780779 0.262432 0.436197 Al\n0.551229 0.483369 0.220300 O\n0.429490 0.789609 0.484715 O\n0.051229 0.016631 0.779700 O\n0.448771 0.983369 0.279700 O\n0.948771 0.516631 0.720301 O\n0.448771 0.516631 0.779700 O\n0.948771 0.983369 0.220300 O\n0.551229 0.016631 0.720301 O\n0.051229 0.483369 0.279700 O\n0.808399 0.158928 0.349202 O\n0.308399 0.341072 0.650799 O\n0.191600 0.658928 0.150798 O\n0.691600 0.841072 0.849202 O\n0.191600 0.841072 0.650799 O\n0.691600 0.658928 0.349202 O\n0.070510 0.210391 0.984715 O\n0.808399 0.341072 0.849202 O\n0.669513 0.403862 0.395235 O\n0.169514 0.096138 0.604765 O\n0.330486 0.903862 0.104765 O\n0.830486 0.596138 0.895235 O\n0.330486 0.596138 0.604765 O\n0.830486 0.903862 0.395235 O\n0.669513 0.096138 0.895235 O\n0.169514 0.403862 0.104765 O\n0.070510 0.289609 0.484715 O\n0.570510 0.210391 0.515286 O\n0.929489 0.789609 0.015286 O\n0.429490 0.710391 0.984715 O\n0.929489 0.710391 0.515286 O\n0.570510 0.289609 0.015286 O\n0.308399 0.158928 0.150798 O\n",
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"structure_string": "K12 Hg2 S8\n1.0\n5.011485 -8.680147 -0.000000\n5.011485 8.680147 0.000000\n0.000000 0.000000 7.600263\nK Hg S\n12 2 8\ndirect\n0.297705 0.148853 0.296075 K\n0.148853 0.297705 0.796075 K\n0.702296 0.851148 0.796075 K\n0.851148 0.702296 0.296075 K\n0.851148 0.148853 0.296075 K\n0.148853 0.851148 0.796075 K\n0.472482 0.944965 0.123131 K\n0.527519 0.055036 0.623131 K\n0.527519 0.472482 0.623131 K\n0.472482 0.527519 0.123131 K\n0.944965 0.472482 0.623131 K\n0.055036 0.527519 0.123131 K\n0.666668 0.333333 -0.001081 Hg\n0.333333 0.666668 0.498918 Hg\n0.811423 0.188578 0.894305 S\n0.622846 0.811424 0.394305 S\n0.811424 0.622846 0.894305 S\n0.188577 0.377155 0.394305 S\n0.377155 0.188577 0.894305 S\n0.666668 0.333333 0.348543 S\n0.333333 0.666668 0.848543 S\n0.188578 0.811423 0.394305 S\n",
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}