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{
"id": "jvasp-10195",
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"structure_string": "Ba3 Sr1 Ta2 O9\n1.0\n3.006069 -5.206665 0.000000\n3.006069 5.206665 -0.000000\n0.000000 -0.000000 7.565966\nBa Sr Ta O\n3 1 2 9\ndirect\n0.333333 0.666667 0.318502 Ba\n0.000000 0.000000 0.000000 Ba\n0.666667 0.333333 0.681499 Ba\n0.000000 0.000000 0.500000 Sr\n0.333333 0.666667 0.836327 Ta\n0.666667 0.333333 0.163673 Ta\n0.500000 0.000000 0.000000 O\n0.000000 0.500000 0.000000 O\n0.500000 0.500000 0.000000 O\n0.821340 0.642680 0.302502 O\n0.821340 0.178661 0.302502 O\n0.357321 0.178661 0.302502 O\n0.178661 0.357321 0.697499 O\n0.178661 0.821340 0.697499 O\n0.642680 0.821340 0.697499 O\n",
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{
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"structure_string": "Cd1 H4 C4 O4\n1.0\n4.651490 0.115327 1.721861\n2.535370 4.367645 0.020918\n0.227801 -0.140045 6.957904\nCd H C O\n1 4 4 4\ndirect\n0.984160 0.868405 0.279202 Cd\n0.201228 -0.007536 0.587959 H\n0.369553 0.085083 0.740322 H\n0.766017 0.199820 0.967016 H\n0.606545 0.465517 0.816817 H\n0.219117 0.400683 0.540499 C\n0.165959 0.189156 0.685621 C\n0.809380 0.362558 0.871923 C\n0.765492 0.615063 0.019895 C\n0.517807 0.333543 0.409789 O\n0.949209 0.648944 0.553937 O\n0.040800 0.578659 0.016499 O\n0.471976 0.850765 0.142013 O\n",
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{
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"structure_string": "Cd1 H4 C4 O4\n1.0\n4.068724 0.056177 0.508557\n0.898827 3.967315 0.537615\n0.031518 -0.025620 7.450774\nCd H C O\n1 4 4 4\ndirect\n0.301597 0.209757 0.716522 Cd\n0.527441 0.134148 0.338732 H\n0.958180 -0.007818 0.258456 H\n0.376639 0.982588 0.094039 H\n0.519517 0.552294 0.174610 H\n0.765245 0.652817 0.461849 C\n0.720843 0.913872 0.298110 C\n0.597308 0.789757 0.134844 C\n0.858580 0.745709 0.971205 C\n0.528384 0.684606 0.595574 O\n0.025665 0.411000 0.461223 O\n0.826893 0.982866 0.837610 O\n0.100383 0.485327 0.971773 O\n",
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{
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"updated_at": "2022-09-04T14:36:44.689279Z",
"structure_string": "Cd1 H4 C4 O4\n1.0\n3.473569 0.021861 0.823857\n1.527602 4.764562 1.136806\n0.071083 -0.114394 7.167955\nCd H C O\n1 4 4 4\ndirect\n0.666403 0.239554 0.728428 Cd\n0.133436 0.976990 0.250497 H\n0.604315 0.027150 0.170926 H\n0.415354 0.488125 0.205474 H\n0.851351 0.454251 0.286783 H\n0.497199 0.880897 0.469929 C\n0.452357 0.879723 0.264649 C\n0.639198 0.595189 0.192481 C\n0.886264 0.599011 0.987773 C\n0.335032 0.124274 0.532176 O\n0.705093 0.668224 0.564289 O\n-0.029147 0.814126 0.896627 O\n0.031395 0.357284 0.923313 O\n",
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{
"id": "jvasp-101946",
"created_at": "2022-09-04T14:37:10.373393Z",
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"structure_string": "Cd1 H4 C4 O4\n1.0\n3.891579 0.119261 0.240857\n0.799765 4.082863 0.788404\n-0.016578 0.075993 7.675643\nCd H C O\n1 4 4 4\ndirect\n0.211297 0.264777 0.278878 Cd\n0.382060 0.956673 0.673763 H\n0.510434 0.516374 0.737259 H\n0.912288 0.013219 0.820516 H\n0.040656 0.572921 0.884006 H\n0.828660 0.725098 0.533661 C\n0.605503 0.745387 0.701407 C\n0.817214 0.784206 0.856359 C\n0.594005 0.804477 0.024097 C\n0.768849 0.969059 0.401810 O\n0.069704 0.466988 0.530765 O\n0.352961 0.062581 0.026987 O\n0.653765 0.560491 0.155933 O\n",
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{
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"created_at": "2022-09-04T14:36:43.150419Z",
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"structure_string": "Cd1 H4 C4 O4\n1.0\n3.657038 -0.078462 -0.106265\n-1.124614 4.400027 -0.270047\n0.061925 -0.053981 7.531503\nCd H C O\n1 4 4 4\ndirect\n0.362299 0.764708 0.266674 Cd\n0.588179 0.975275 0.668755 H\n0.046379 0.997546 0.747351 H\n0.678120 0.531869 0.785988 H\n0.136319 0.554133 0.864587 H\n0.031151 0.245251 0.522165 C\n0.868290 0.137405 0.696759 C\n0.856203 0.392004 0.836585 C\n0.693337 0.284179 0.011181 C\n0.960856 0.050487 0.384873 O\n0.239739 0.515452 0.518679 O\n0.484662 0.014008 0.014669 O\n0.763711 0.478940 0.148476 O\n",
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{
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"structure_string": "Hf1 H8 C6 O4\n1.0\n3.800346 0.081217 -0.415425\n1.498155 4.377823 0.698109\n-1.090894 -0.080652 9.726341\nHf H C O\n1 8 6 4\ndirect\n0.297451 0.827442 0.312512 Hf\n0.827036 0.373093 0.923253 H\n0.486271 0.198419 0.903715 H\n0.284416 0.900736 0.860912 H\n0.951187 0.717088 0.834786 H\n0.519684 0.220729 0.671856 H\n0.011868 0.350346 0.627149 H\n0.001955 0.900185 0.602665 H\n0.504028 0.756913 0.655804 H\n0.531550 0.409638 0.929697 C\n0.240008 0.695886 0.825866 C\n0.251505 0.705585 0.669954 C\n0.253492 0.439429 0.455688 C\n0.257479 0.414757 0.612395 C\n0.537985 0.403733 0.084725 C\n0.326409 0.640953 0.120404 O\n0.316739 0.153822 0.417098 O\n0.890912 0.657422 0.363718 O\n0.746430 0.156942 0.173398 O\n",
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{
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"structure_string": "Hf1 H8 C6 O4\n1.0\n3.801668 -0.119869 0.323700\n-1.201147 4.296323 -1.380396\n-0.081050 0.067975 9.676806\nHf H C O\n1 8 6 4\ndirect\n0.021146 0.872656 0.691388 Hf\n0.769566 0.893519 0.085106 H\n0.294797 0.803221 0.117010 H\n0.789827 0.418569 0.148256 H\n0.305764 0.273229 0.144818 H\n0.048486 0.007797 0.328951 H\n0.660917 0.142794 0.352550 H\n0.241180 0.652153 0.364781 H\n0.586658 0.509461 0.398264 H\n0.517357 0.695375 0.078452 C\n0.537993 0.490824 0.173967 C\n0.525051 0.651125 0.335809 C\n0.870364 0.113996 0.546262 C\n0.782247 0.985978 0.384896 C\n0.428835 0.530402 0.920779 C\n0.196915 0.254829 0.886097 O\n0.963602 0.438679 0.585985 O\n0.573020 -0.009676 0.636911 O\n0.568307 0.681232 0.829254 O\n",
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{
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"structure_string": "Hf1 H8 C6 O4\n1.0\n3.795290 0.225357 0.301908\n1.106159 4.462977 0.713282\n-0.150046 0.450414 9.430099\nHf H C O\n1 8 6 4\ndirect\n0.039709 0.828442 0.309015 Hf\n0.790853 0.202884 0.917210 H\n0.318279 0.322248 0.881951 H\n0.810209 0.741046 0.853943 H\n0.327179 0.881678 0.856399 H\n0.066097 0.331564 0.673150 H\n0.678801 0.220565 0.647186 H\n0.261407 0.722314 0.635896 H\n0.606277 0.899352 0.603278 H\n0.538183 0.393019 0.922315 C\n0.558828 0.694235 0.827480 C\n0.544521 0.695548 0.665215 C\n0.891348 0.442974 0.455105 C\n0.801031 0.409234 0.616312 C\n0.444394 0.400665 0.079747 C\n0.209888 0.641861 0.113289 O\n-0.016015 0.156516 0.415420 O\n0.591424 0.656079 0.362979 O\n0.580668 0.157847 0.171994 O\n",
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{
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{
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{
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}