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"results": [
{
"id": "jvasp-101883",
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"structure_string": "Sn1 H8 C5 O6\n1.0\n4.790779 -0.034172 -0.264289\n0.679278 5.451084 -0.726560\n0.016354 0.276469 7.142534\nSn H C O\n1 8 5 6\ndirect\n0.968867 0.600476 0.644604 Sn\n0.387413 0.159310 0.363610 H\n0.330194 0.910915 0.204722 H\n0.691310 -0.005415 0.997035 H\n0.841062 0.189007 0.175464 H\n0.432607 0.495209 0.171525 H\n0.231085 0.300873 0.023321 H\n0.293410 0.910992 0.702696 H\n0.989539 0.155594 0.598191 H\n0.497548 0.016735 0.267659 C\n0.642892 0.128515 0.117357 C\n0.543004 0.445948 0.884131 C\n0.683752 0.855457 0.390498 C\n0.443933 0.349852 0.055394 C\n0.586829 0.814377 0.550525 O\n0.104268 0.915076 0.752194 O\n0.938467 0.280590 0.506748 O\n0.396347 0.440530 0.730636 O\n0.787627 0.523507 0.895727 O\n0.928533 0.753935 0.351831 O\n",
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{
"id": "jvasp-112078",
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"structure_string": "Sn1 H8 C5 O6\n1.0\n5.029785 0.000061 0.388491\n0.207405 4.919434 0.533960\n0.111582 -0.090543 7.298897\nSn H C O\n1 8 5 6\ndirect\n0.200526 0.988272 0.238901 Sn\n0.559308 0.853612 0.857912 H\n0.434314 0.585852 0.752758 H\n0.957584 0.433574 0.904803 H\n0.977931 0.712303 0.739360 H\n0.701462 0.218529 0.639156 H\n0.048728 0.191955 0.648174 H\n0.826456 0.044830 0.038945 H\n0.572899 0.913380 0.441467 H\n0.574373 0.633887 0.850887 C\n0.862177 0.533902 0.786340 C\n0.920894 0.478431 0.440952 C\n0.483806 0.494586 0.036948 C\n0.879679 0.340098 0.633941 C\n0.476832 0.233140 0.048932 O\n0.003435 0.954500 0.021555 O\n0.398616 0.010068 0.458594 O\n0.959769 0.340661 0.300601 O\n0.915874 0.739240 0.420100 O\n0.425704 0.622752 0.179657 O\n",
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{
"id": "jvasp-103868",
"created_at": "2022-09-04T14:37:10.534359Z",
"updated_at": "2022-09-04T14:37:10.534370Z",
"structure_string": "Sn1 H8 C5 O4\n1.0\n4.777305 -0.084916 0.080976\n0.097338 5.804990 2.505210\n-0.104206 0.259077 6.579884\nSn H C O\n1 8 5 4\ndirect\n0.321268 0.069689 0.088866 Sn\n0.984361 0.801251 0.986330 H\n0.168832 0.992097 0.735641 H\n0.522122 0.140359 0.440284 H\n0.340362 0.736231 0.944529 H\n0.253986 0.350547 0.296515 H\n0.464283 0.631683 0.645743 H\n0.738893 0.754931 0.748393 H\n0.600800 0.392430 0.184217 H\n0.441578 0.261733 0.274953 C\n0.186918 0.874572 0.914887 C\n0.812685 0.773661 0.423135 C\n0.817358 0.405052 0.794291 C\n0.690322 0.647774 0.659111 C\n0.667604 0.226073 0.831320 O\n0.059201 0.855103 0.404899 O\n0.658759 0.793982 0.257582 O\n0.066930 0.395030 0.866213 O\n",
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{
"id": "jvasp-103865",
"created_at": "2022-09-04T14:37:07.318831Z",
"updated_at": "2022-09-04T14:37:07.318858Z",
"structure_string": "Sn1 H8 C5 O4\n1.0\n4.855748 0.110145 -0.000227\n-0.939858 5.580504 -1.812035\n0.020906 -0.132954 6.576329\nSn H C O\n1 8 5 4\ndirect\n0.121733 0.124630 0.897549 Sn\n0.242285 0.048470 0.268170 H\n0.083525 0.773208 0.072166 H\n0.465431 0.500978 0.858581 H\n0.443624 0.885381 0.052623 H\n0.170718 0.425544 0.670419 H\n0.445905 0.571941 0.438649 H\n0.623952 0.725037 0.275602 H\n0.455997 0.249914 0.616730 H\n0.330347 0.355519 0.739948 C\n0.238314 0.933765 0.100588 C\n0.787337 0.398458 0.271282 C\n0.832035 0.789103 0.572047 C\n0.651312 0.621318 0.383642 C\n0.724044 0.942006 0.729036 O\n0.880258 0.391127 0.081091 O\n0.802951 0.243343 0.356963 O\n0.092782 0.790208 0.577524 O\n",
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{
"id": "jvasp-112058",
"created_at": "2022-09-04T14:38:42.221701Z",
"updated_at": "2022-09-04T14:38:42.221738Z",
"structure_string": "Sn1 H8 C5 O4\n1.0\n4.907649 0.071408 -0.210428\n-0.837061 5.707878 -1.881113\n-0.095160 -0.246941 6.499301\nSn H C O\n1 8 5 4\ndirect\n0.248606 0.922059 0.098316 Sn\n0.028908 0.238346 0.973959 H\n0.386223 0.262237 0.928637 H\n0.550382 0.621085 0.204298 H\n0.142609 0.028902 0.735092 H\n0.213448 0.602724 0.299345 H\n0.553286 0.419762 0.586291 H\n0.693788 0.225064 0.695272 H\n0.471025 0.845741 0.450027 H\n0.391215 0.720927 0.285638 C\n0.197353 0.140649 0.907703 C\n0.947844 0.551429 0.772917 C\n0.840215 0.213000 0.391923 C\n0.745550 0.351918 0.611308 C\n0.681817 0.171803 0.218627 O\n0.197413 0.593626 0.743988 O\n0.850842 0.680360 0.948942 O\n0.072846 0.134900 0.393684 O\n",
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{
"id": "jvasp-104006",
"created_at": "2022-09-04T14:36:52.971658Z",
"updated_at": "2022-09-04T14:36:52.971673Z",
"structure_string": "Sn2 H16 C8 F4\n1.0\n3.632211 0.031689 -0.319724\n-0.058913 5.213833 -1.044780\n-0.001630 -0.395476 13.516209\nSn H C F\n2 16 8 4\ndirect\n0.995438 0.982337 0.973336 Sn\n0.994601 0.982278 0.473330 Sn\n0.689273 0.537644 0.874371 H\n0.168966 0.495150 0.897421 H\n0.809035 0.745862 0.727484 H\n0.168442 0.495150 0.397434 H\n0.688754 0.537507 0.374303 H\n0.282702 0.701427 0.251522 H\n0.808613 0.745702 0.227437 H\n0.283085 0.701179 0.751456 H\n0.301196 0.426867 0.572282 H\n0.181426 0.218775 0.719185 H\n0.707374 0.263458 0.695226 H\n0.301715 0.427005 0.072348 H\n0.822059 0.469541 0.049251 H\n0.181866 0.218935 0.219231 H\n0.707773 0.263208 0.195162 H\n0.821537 0.469542 0.549263 H\n0.959773 0.614788 0.867265 C\n0.012819 0.620208 0.757108 C\n0.959253 0.614736 0.367247 C\n0.977929 0.344418 0.189565 C\n0.977633 0.344427 0.689566 C\n0.030650 0.349827 0.579405 C\n0.031174 0.349879 0.079422 C\n0.012535 0.620218 0.257109 C\n0.467677 0.099931 0.394396 F\n0.468250 0.099970 0.894397 F\n0.522745 0.864690 0.052276 F\n0.522169 0.864653 0.552275 F\n",
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{
"id": "jvasp-112209",
"created_at": "2022-09-04T14:38:46.680337Z",
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"structure_string": "Sn2 H16 C8 F4\n1.0\n4.422193 0.011810 -0.034387\n-1.841858 7.114428 -0.316533\n0.037711 0.011421 8.824541\nSn H C F\n2 16 8 4\ndirect\n0.999492 0.896753 0.008952 Sn\n0.429489 0.580829 0.497564 Sn\n0.122445 0.849096 0.722152 H\n0.815568 0.964535 0.729734 H\n0.379420 0.142233 0.631860 H\n0.334590 0.626133 0.204551 H\n0.648526 0.519195 0.226802 H\n0.240154 0.294817 0.087121 H\n0.945886 0.327358 0.212086 H\n0.487291 0.176271 0.824262 H\n0.049693 0.335527 0.874742 H\n0.306538 0.628634 0.784335 H\n0.613457 0.513227 0.776826 H\n0.780519 0.958488 0.279715 H\n0.094440 0.851539 0.301979 H\n0.483176 0.150311 0.294404 H\n0.188927 0.182856 0.419377 H\n0.941729 0.301439 0.682351 H\n0.048515 0.968488 0.774654 C\n0.284870 0.153951 0.746453 C\n0.405733 0.510688 0.257276 C\n0.237311 0.156695 0.298334 C\n0.144185 0.323772 0.760141 C\n0.380508 0.509226 0.731889 C\n0.023305 0.966977 0.249237 C\n0.191750 0.320974 0.208161 C\n0.527215 0.860448 0.506825 F\n0.901728 0.617137 -0.000288 F\n0.501612 0.896159 0.010141 F\n0.927290 0.581204 0.496345 F\n",
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{
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"created_at": "2022-09-04T14:37:04.135164Z",
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"structure_string": "Sn2 H16 C8 F4\n1.0\n4.269866 0.073776 -0.320759\n-1.738391 4.299468 -0.088712\n0.275159 -0.072247 14.189947\nSn H C F\n2 16 8 4\ndirect\n-0.031622 0.924752 0.949054 Sn\n0.715146 0.059081 0.471616 Sn\n0.602989 0.495672 0.828721 H\n0.013817 0.631011 0.789336 H\n0.522409 0.715813 0.682122 H\n0.564295 0.255535 0.306697 H\n0.005394 0.390390 0.332985 H\n0.567050 0.730823 0.254700 H\n0.999138 0.850576 0.287467 H\n0.554908 0.010933 0.767092 H\n0.080586 0.488130 0.591950 H\n0.161130 0.267980 0.738550 H\n0.128632 0.972862 0.653578 H\n0.678028 0.593401 0.087665 H\n0.119114 0.728257 0.113984 H\n0.684218 0.133177 0.133192 H\n0.116299 0.252967 0.165968 H\n0.669768 0.352832 0.631341 H\n0.809347 0.702554 0.810453 C\n0.697410 0.881704 0.735579 C\n0.775142 0.183994 0.327623 C\n0.880806 0.050394 0.160641 C\n0.986136 0.102096 0.685091 C\n0.874214 0.281261 0.610219 C\n0.908281 0.799800 0.093042 C\n0.802561 0.933379 0.260023 C\n0.547486 0.590711 0.471319 F\n0.136059 0.393132 0.949366 F\n0.493838 0.024219 0.947786 F\n0.189675 0.959588 0.472871 F\n",
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{
"id": "jvasp-103995",
"created_at": "2022-09-04T14:36:45.050952Z",
"updated_at": "2022-09-04T14:36:45.050987Z",
"structure_string": "Sn2 H16 C8 Cl4\n1.0\n3.991139 -0.001482 0.003465\n0.001675 5.993984 0.782007\n-0.011835 -0.105332 13.383367\nSn H C Cl\n2 16 8 4\ndirect\n0.092592 0.160459 0.038815 Sn\n0.137482 0.660467 0.538814 Sn\n0.988766 0.542248 0.115856 H\n0.412896 0.456773 0.134463 H\n0.810123 0.270584 0.264114 H\n0.241009 0.042254 0.615879 H\n0.816914 0.956693 0.634457 H\n0.419671 0.770523 0.764130 H\n0.007547 0.668596 0.780166 H\n0.222232 0.168635 0.280166 H\n0.240937 0.278675 0.461742 H\n0.419681 0.550400 0.313497 H\n0.007569 0.652350 0.297447 H\n0.412846 0.864124 0.943166 H\n0.988698 0.778697 0.961759 H\n0.222256 0.152297 0.797460 H\n0.810133 0.050378 0.813499 H\n0.816867 0.364297 0.443154 H\n0.151731 0.403309 0.145505 C\n0.074734 0.318990 0.254872 C\n0.078097 0.903279 0.645512 C\n0.074737 0.001953 0.822750 C\n0.155070 0.501996 0.322741 C\n0.078066 0.417673 0.432106 C\n0.151698 0.917615 0.932117 C\n0.155066 0.818945 0.754879 C\n0.600678 0.429773 0.643168 Cl\n0.629166 0.391116 0.934454 Cl\n0.629188 0.929804 0.143171 Cl\n0.600649 0.891168 0.434452 Cl\n",
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},
{
"id": "jvasp-101876",
"created_at": "2022-09-04T14:36:52.187469Z",
"updated_at": "2022-09-04T14:36:52.187496Z",
"structure_string": "Sn1 H6 C4 O4\n1.0\n5.490855 -0.114035 2.909346\n2.310745 5.221184 1.871733\n0.006501 -0.085758 6.008245\nSn H C O\n1 6 4 4\ndirect\n0.469729 0.222698 0.886596 Sn\n0.965582 0.539565 0.949715 H\n0.965692 0.285363 0.202638 H\n0.035347 0.542129 0.207244 H\n-0.013155 0.966942 0.628467 H\n0.935114 0.270830 0.682124 H\n0.935575 0.014635 0.934511 H\n0.056813 0.421727 0.085816 C\n0.885246 0.103876 0.768068 C\n0.478623 0.027218 0.472576 C\n0.478727 0.808573 0.691137 C\n0.478591 -0.005847 0.277214 O\n0.475900 0.848734 0.890007 O\n0.475560 0.226192 0.512813 O\n0.478609 0.613228 0.658105 O\n",
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{
"id": "jvasp-101872",
"created_at": "2022-09-04T14:36:44.183217Z",
"updated_at": "2022-09-04T14:36:44.183241Z",
"structure_string": "Sn1 H6 C4 O4\n1.0\n4.761210 0.178116 -2.043871\n-1.240353 5.137026 -0.851810\n0.090228 -0.053408 6.020156\nSn H C O\n1 6 4 4\ndirect\n0.409761 0.688657 0.475061 Sn\n0.197624 0.302227 0.076746 H\n0.922270 0.479552 0.079208 H\n0.187520 0.602171 0.979751 H\n0.632076 0.775244 -0.029603 H\n0.897279 0.897816 0.870867 H\n0.621928 0.075146 0.873327 H\n0.143935 0.493479 0.103764 C\n0.675621 0.883893 0.846339 C\n0.061237 0.154986 0.515904 C\n0.758249 0.222344 0.434198 C\n0.062581 0.915563 0.484926 O\n0.277219 0.338223 0.609054 O\n0.542252 0.039125 0.341052 O\n0.756927 0.461770 0.465184 O\n",
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},
{
"id": "jvasp-112060",
"created_at": "2022-09-04T14:38:43.641476Z",
"updated_at": "2022-09-04T14:38:43.641502Z",
"structure_string": "Sn1 H6 C4 O6\n1.0\n4.875641 -0.138950 0.468789\n0.761131 5.066481 0.859974\n-0.097953 0.150295 6.598123\nSn H C O\n1 6 4 6\ndirect\n0.012998 0.821169 0.692724 Sn\n0.344401 0.176693 0.069534 H\n0.230277 0.485503 0.142181 H\n0.681567 0.465628 0.315973 H\n0.795731 0.156842 0.243296 H\n-0.023436 0.157789 0.917400 H\n0.049449 0.484558 0.468045 H\n0.416354 0.355495 0.103959 C\n0.609639 0.286828 0.281522 C\n0.543346 0.493726 0.905567 C\n0.482633 0.148564 0.479893 C\n0.042345 0.968256 0.944370 O\n0.983654 0.674086 0.441073 O\n0.627430 0.062526 0.636217 O\n0.222656 0.128563 0.490563 O\n0.803320 0.513740 0.894870 O\n0.398516 0.579710 0.749251 O\n",
"nsites": 17,
"nelements": 4,
"elements": [
"Sn",
"H",
"C",
"O"
],
"chemical_system": "C-H-O-Sn",
"density": 2.732383111234118,
"density_atomic": 0.10406801177437407,
"volume": 163.35471111773577,
"volume_molar": 5.786735671530246,
"formula_full": "Sn1 H6 C4 O6",
"formula_reduced": "SnH6(C2O3)2",
"formula_anonymous": "AB4C6D6",
"energy_above_hull": 3.963532511764705,
"spacegroup": 2
}
]
}