HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-id&page=4406",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-id&page=4404",
"results": [
{
"id": "jvasp-103867",
"created_at": "2022-09-04T14:36:43.818300Z",
"updated_at": "2022-09-04T14:36:43.818317Z",
"structure_string": "Sn1 H24 C13 O4\n1.0\n4.901474 -0.021617 -0.528824\n-0.650597 6.813488 -2.101729\n-0.021207 -0.200466 11.070327\nSn H C O\n1 24 13 4\ndirect\n0.417155 0.594667 0.888376 Sn\n0.968391 0.806127 0.539257 H\n0.309699 0.539322 0.635295 H\n0.173618 0.763429 0.724450 H\n0.475477 0.685977 0.144143 H\n0.121630 0.602999 0.079237 H\n0.884413 0.866861 0.398214 H\n0.999245 0.525169 0.705517 H\n0.524252 0.079229 0.515982 H\n0.874183 0.166936 0.574524 H\n0.875544 0.037167 0.750678 H\n0.538103 0.910204 0.693064 H\n0.367469 0.425476 0.071372 H\n0.006656 0.181766 0.366616 H\n0.705045 0.095811 0.255569 H\n0.419750 0.710681 0.511901 H\n0.439122 0.690946 0.351379 H\n0.014073 0.510577 0.330296 H\n0.147383 0.992034 0.163694 H\n0.711472 0.428721 0.220663 H\n0.086382 0.116550 0.972431 H\n0.826200 0.259332 0.042080 H\n0.764246 0.468211 0.506036 H\n0.464867 0.367793 0.396206 H\n0.258259 0.242292 0.193923 H\n0.560436 0.683184 0.439208 C\n0.648440 0.474773 0.416642 C\n0.822780 0.410623 0.307428 C\n0.930856 0.127066 0.037199 C\n0.073837 0.136387 0.170695 C\n0.895321 0.197606 0.278852 C\n0.725339 0.948423 0.982487 C\n0.715140 0.046132 0.563987 C\n0.799792 0.848429 0.482384 C\n0.547997 0.220890 0.772038 C\n0.197882 0.609066 0.715050 C\n0.334874 0.574125 0.069345 C\n0.673702 0.040921 0.699356 C\n0.709878 0.385333 0.822979 O\n0.814412 0.775604 0.938932 O\n0.469803 0.957884 0.979684 O\n0.295643 0.221102 0.780586 O\n",
"nsites": 42,
"nelements": 4,
"elements": [
"Sn",
"H",
"C",
"O"
],
"chemical_system": "C-H-O-Sn",
"density": 1.6410933642991576,
"density_atomic": 0.11433581231527745,
"volume": 367.3389741106339,
"volume_molar": 5.267064306495794,
"formula_full": "Sn1 H24 C13 O4",
"formula_reduced": "SnH24C13O4",
"formula_anonymous": "AB4C13D24",
"energy_above_hull": 4.639529183333334,
"spacegroup": 1
},
{
"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",
"nsites": 18,
"nelements": 4,
"elements": [
"Sn",
"H",
"C",
"O"
],
"chemical_system": "C-H-O-Sn",
"density": 2.3437422948312547,
"density_atomic": 0.10128919089812767,
"volume": 177.70899185189097,
"volume_molar": 5.945492018054336,
"formula_full": "Sn1 H8 C5 O4",
"formula_reduced": "SnH8C5O4",
"formula_anonymous": "AB4C5D8",
"energy_above_hull": 4.217176983333333,
"spacegroup": 1
},
{
"id": "jvasp-103864",
"created_at": "2022-09-04T14:37:06.064843Z",
"updated_at": "2022-09-04T14:37:06.064864Z",
"structure_string": "H12 C14 N4 O2\n1.0\n4.618844 0.049885 0.035836\n0.158040 6.293416 0.399587\n-0.055099 0.161670 9.506241\nH C N O\n12 14 4 2\ndirect\n0.128398 0.146990 0.785010 H\n0.469370 0.089890 0.667511 H\n0.971708 0.333707 0.225865 H\n0.299181 0.615637 0.294122 H\n0.291747 0.877077 0.145074 H\n0.304297 0.424600 0.532010 H\n0.136790 -0.000995 0.361368 H\n0.482651 0.571956 0.946586 H\n0.312672 0.276625 0.108378 H\n0.149303 0.546542 0.748306 H\n0.141856 0.807942 0.599252 H\n0.958411 0.851651 0.946798 H\n0.953366 0.092286 0.398488 C\n0.576795 0.142298 0.570014 C\n0.487711 0.331311 0.494888 C\n0.677774 0.726398 0.207917 C\n0.810849 0.020156 0.522296 C\n0.630219 0.403436 0.371077 C\n0.864282 0.281298 0.323361 C\n0.623154 0.044367 0.039347 C\n0.950463 0.175806 0.856884 C\n0.763262 0.697201 0.685462 C\n0.817904 0.379241 0.854039 C\n0.490600 0.247805 0.036504 C\n0.585636 0.414362 0.945267 C\n0.855425 0.009247 0.948121 C\n0.920997 0.833348 0.598630 N\n0.929087 0.543573 0.761867 N\n0.511960 0.880034 0.131514 N\n0.520043 0.590239 0.294741 N\n0.492373 0.709546 0.693767 O\n0.948659 0.714054 0.199615 O\n",
"nsites": 32,
"nelements": 4,
"elements": [
"H",
"C",
"N",
"O"
],
"chemical_system": "C-H-N-O",
"density": 1.6142159076993563,
"density_atomic": 0.11595495017561902,
"volume": 275.9692445344899,
"volume_molar": 5.193517612554872,
"formula_full": "H12 C14 N4 O2",
"formula_reduced": "H6C7N2O",
"formula_anonymous": "AB2C6D7",
"energy_above_hull": 5.479144999999999,
"spacegroup": 2
},
{
"id": "jvasp-103863",
"created_at": "2022-09-04T14:36:41.844776Z",
"updated_at": "2022-09-04T14:36:41.844803Z",
"structure_string": "H12 C14 S2 N4\n1.0\n5.437560 -0.011994 -0.078470\n-0.237533 7.269521 -0.477774\n-0.046240 0.031675 7.793779\nH C S N\n12 14 2 4\ndirect\n0.909077 0.080610 0.809782 H\n0.075533 0.734817 0.620264 H\n0.065728 0.750504 0.303196 H\n0.342952 0.489719 0.279205 H\n0.350363 0.478523 0.594160 H\n0.540190 0.495855 0.826338 H\n0.496823 0.566852 0.055680 H\n0.030415 0.237381 0.265937 H\n0.863086 0.004511 0.041342 H\n0.309493 0.977945 0.261251 H\n0.320589 0.988336 0.582246 H\n0.042551 0.248742 0.586748 H\n0.714536 0.604896 0.628902 C\n0.914432 0.682848 0.545726 C\n0.909385 0.690818 0.366668 C\n0.705369 0.619745 0.269118 C\n0.502803 0.545252 0.354245 C\n0.507068 0.538632 0.530032 C\n0.816469 0.642395 0.951883 C\n0.465922 0.042502 0.333673 C\n0.874284 0.185625 0.336550 C\n0.668584 0.107411 0.245021 C\n0.472647 0.048028 0.513384 C\n0.683258 0.118482 0.604146 C\n0.586072 0.129766 0.923838 C\n0.881203 0.191394 0.514531 C\n0.312540 0.235334 0.925222 S\n0.098877 0.748070 0.961145 S\n0.694437 0.576663 0.804676 N\n0.727403 0.102269 0.782023 N\n0.700851 0.070261 0.065255 N\n0.671637 0.614249 0.089772 N\n",
"nsites": 32,
"nelements": 4,
"elements": [
"H",
"C",
"S",
"N"
],
"chemical_system": "C-H-N-S",
"density": 1.6189961844344152,
"density_atomic": 0.1038589816115537,
"volume": 308.1100883473345,
"volume_molar": 5.798382255011513,
"formula_full": "H12 C14 S2 N4",
"formula_reduced": "H6C7SN2",
"formula_anonymous": "AB2C6D7",
"energy_above_hull": 5.449389781250001,
"spacegroup": 1
},
{
"id": "jvasp-103856",
"created_at": "2022-09-04T14:36:41.629264Z",
"updated_at": "2022-09-04T14:36:41.629293Z",
"structure_string": "H2 C4 S4 N2 O2\n1.0\n3.668600 -0.028713 0.012426\n-0.410142 4.185795 -0.115653\n-0.001905 -0.085119 13.182298\nH C S N O\n2 4 4 2 2\ndirect\n0.782700 0.210192 0.155810 H\n0.282705 0.210191 0.655810 H\n0.836067 0.670456 0.207871 C\n0.336070 0.670455 0.707871 C\n0.331303 0.179369 0.808284 C\n0.831301 0.179370 0.308284 C\n0.480928 0.303866 0.919004 S\n-0.019071 0.303866 0.419004 S\n0.001923 0.795100 0.098089 S\n0.501927 0.795100 0.598089 S\n0.766561 0.345211 0.223143 N\n0.266564 0.345210 0.723143 N\n0.737354 0.843783 0.290507 O\n0.237357 0.843783 0.790507 O\n",
"nsites": 14,
"nelements": 5,
"elements": [
"H",
"C",
"S",
"N",
"O"
],
"chemical_system": "C-H-N-O-S",
"density": 1.9569042412703943,
"density_atomic": 0.06922583392626849,
"volume": 202.23663921349382,
"volume_molar": 8.699267915521396,
"formula_full": "H2 C4 S4 N2 O2",
"formula_reduced": "HC2S2NO",
"formula_anonymous": "ABCD2E2",
"energy_above_hull": 4.233143821428571,
"spacegroup": 1
},
{
"id": "jvasp-103855",
"created_at": "2022-09-04T14:36:37.772519Z",
"updated_at": "2022-09-04T14:36:37.772547Z",
"structure_string": "H10 C14 N2 O4\n1.0\n3.542320 -0.090350 0.292810\n-0.139170 7.615961 3.000743\n-0.193452 -0.082865 10.284317\nH C N O\n10 14 2 4\ndirect\n0.683043 0.763915 0.633073 H\n0.730008 0.088810 0.978238 H\n0.248617 0.702506 0.810716 H\n0.248611 0.202508 0.310714 H\n0.307818 0.525765 0.656080 H\n0.730013 0.588810 0.478238 H\n0.959401 0.556271 0.293192 H\n0.959382 0.056273 0.793190 H\n0.683046 0.263913 0.133074 H\n0.307823 0.025765 0.156080 H\n0.069908 0.211626 0.593599 C\n0.846574 0.222500 0.942562 C\n0.846578 0.722500 0.442562 C\n0.817850 0.318879 0.028037 C\n0.817849 0.818881 0.528036 C\n0.069917 0.711623 0.093601 C\n0.027427 0.296149 0.808171 C\n0.965490 0.990353 0.481021 C\n0.965496 0.490351 0.981023 C\n0.171820 0.468424 0.760674 C\n0.171823 0.968424 0.260674 C\n0.138531 0.567948 0.847018 C\n0.138528 0.067949 0.347017 C\n0.027433 0.796149 0.308171 C\n0.045212 0.181540 0.733392 N\n0.045225 0.681538 0.233394 N\n0.199353 0.341056 0.496278 O\n0.905793 0.063295 0.583667 O\n0.905808 0.563291 0.083670 O\n0.199355 0.841054 0.996278 O\n",
"nsites": 30,
"nelements": 4,
"elements": [
"H",
"C",
"N",
"O"
],
"chemical_system": "C-H-N-O",
"density": 1.6101873988692001,
"density_atomic": 0.10764618109355588,
"volume": 278.690796972415,
"volume_molar": 5.59438402628155,
"formula_full": "H10 C14 N2 O4",
"formula_reduced": "H5C7NO2",
"formula_anonymous": "AB2C5D7",
"energy_above_hull": 5.37410935,
"spacegroup": 1
},
{
"id": "jvasp-103854",
"created_at": "2022-09-04T14:36:59.112503Z",
"updated_at": "2022-09-04T14:36:59.112537Z",
"structure_string": "H6 C10 S2 N2 O4\n1.0\n3.794430 -0.071029 0.057145\n-1.985407 7.350584 -2.106065\n0.349448 -0.117063 9.360560\nH C S N O\n6 10 2 2 4\ndirect\n0.793105 0.860960 0.321854 H\n0.793144 0.361010 0.821765 H\n0.110414 0.062832 0.144576 H\n0.111503 0.562647 0.644452 H\n0.738737 0.024464 0.853435 H\n0.737703 0.524577 0.353402 H\n0.780430 0.369274 0.140255 C\n0.780988 0.869138 0.640254 C\n0.139946 0.568108 0.001148 C\n0.140543 0.067921 0.501125 C\n0.427358 0.757038 0.835903 C\n0.008896 0.487789 0.857176 C\n0.008913 0.987721 0.357220 C\n0.175652 0.598379 0.762436 C\n0.175115 0.098436 0.262502 C\n0.426996 0.257055 0.335906 C\n0.469075 0.275119 0.523962 S\n0.468546 0.775299 0.024038 S\n0.654642 0.895248 0.781225 N\n0.653848 0.395344 0.281194 N\n0.696453 0.729425 0.535167 O\n0.030850 0.031729 0.634748 O\n0.029655 0.532043 0.134758 O\n0.696545 0.229501 0.035198 O\n",
"nsites": 24,
"nelements": 5,
"elements": [
"H",
"C",
"S",
"N",
"O"
],
"chemical_system": "C-H-N-O-S",
"density": 1.8117057528382785,
"density_atomic": 0.09275677425040726,
"volume": 258.74120994343036,
"volume_molar": 6.492399944550206,
"formula_full": "H6 C10 S2 N2 O4",
"formula_reduced": "H3C5SNO2",
"formula_anonymous": "ABC2D3E5",
"energy_above_hull": 5.040990854166666,
"spacegroup": 1
},
{
"id": "jvasp-103851",
"created_at": "2022-09-04T14:36:39.443471Z",
"updated_at": "2022-09-04T14:36:39.443496Z",
"structure_string": "H12 C14 N4 O2\n1.0\n4.689766 0.000247 0.000267\n-2.345739 6.750256 -0.585042\n-0.000294 -0.245287 8.801878\nH C N O\n12 14 4 2\ndirect\n0.411078 0.993222 0.675757 H\n0.379656 0.320046 0.312823 H\n0.818122 0.045144 0.863478 H\n0.024273 0.785279 0.935014 H\n0.921605 0.579892 0.741253 H\n0.097282 0.993194 0.175736 H\n0.100492 0.371995 0.000563 H\n0.742257 0.045130 0.363458 H\n0.786738 0.371972 0.500538 H\n0.276204 0.785301 0.435028 H\n0.173505 0.579913 0.241267 H\n0.455561 0.320063 0.812838 H\n0.878409 0.289317 0.038014 C\n0.476747 0.261790 0.214250 C\n0.319366 0.075871 0.138284 C\n0.349608 0.682594 0.838151 C\n0.760510 0.370587 0.164723 C\n0.437262 0.994602 0.011572 C\n0.721027 0.103399 0.962048 C\n0.125278 0.370584 0.664720 C\n0.271685 0.075886 0.638294 C\n0.848183 0.682590 0.338151 C\n0.072536 0.994606 0.511574 C\n0.926126 0.289303 0.538002 C\n0.897590 0.103390 0.462038 C\n0.300225 0.261801 0.714257 C\n0.944608 0.552276 0.243034 N\n0.074940 0.812924 0.433263 N\n0.122865 0.552265 0.743027 N\n0.253169 0.812913 0.933257 N\n0.580790 0.682569 0.338159 O\n0.616993 0.682604 0.838164 O\n",
"nsites": 32,
"nelements": 4,
"elements": [
"H",
"C",
"N",
"O"
],
"chemical_system": "C-H-N-O",
"density": 1.6025719792510875,
"density_atomic": 0.11511852480239135,
"volume": 277.97437514883154,
"volume_molar": 5.231252546310343,
"formula_full": "H12 C14 N4 O2",
"formula_reduced": "H6C7N2O",
"formula_anonymous": "AB2C6D7",
"energy_above_hull": 5.479199374999999,
"spacegroup": 15
},
{
"id": "jvasp-103850",
"created_at": "2022-09-04T14:37:00.321586Z",
"updated_at": "2022-09-04T14:37:00.321617Z",
"structure_string": "H10 C16 S2 N2 O2\n1.0\n3.731971 -0.083535 0.482342\n0.988187 8.655428 2.651449\n0.057139 -0.157274 10.409020\nH C S N O\n10 16 2 2 2\ndirect\n0.103126 0.356060 0.152757 H\n0.537952 0.995534 0.828921 H\n0.142489 0.227123 0.374841 H\n0.642489 0.727122 0.874841 H\n0.046928 0.372849 0.548880 H\n0.037951 0.495534 0.328921 H\n0.864648 0.825274 0.472913 H\n0.364649 0.325274 0.972913 H\n0.603126 0.856060 0.652757 H\n0.546928 0.872849 0.048880 H\n0.799257 0.191524 0.702752 C\n0.671671 0.045034 0.729769 C\n0.171671 0.545033 0.229769 C\n0.704578 0.968558 0.631754 C\n0.204578 0.468558 0.131754 C\n0.206882 0.920055 0.316105 C\n0.706882 0.420054 0.816105 C\n0.299256 0.691524 0.202752 C\n0.945883 0.260627 0.570768 C\n0.387770 0.531211 0.004285 C\n0.445884 0.760627 0.070767 C\n0.999433 0.179732 0.472708 C\n0.499434 0.679732 0.972708 C\n0.305391 0.751592 0.317960 C\n0.805393 0.251591 0.817960 C\n0.887771 0.031211 0.504285 C\n0.925231 0.137559 0.962632 S\n0.425230 0.637559 0.462633 S\n0.458006 0.429241 0.924176 N\n0.958006 0.929240 0.424176 N\n0.848922 0.528120 0.734566 O\n0.348920 0.028119 0.234567 O\n",
"nsites": 32,
"nelements": 5,
"elements": [
"H",
"C",
"S",
"N",
"O"
],
"chemical_system": "C-H-N-O-S",
"density": 1.6020005915794957,
"density_atomic": 0.09458515568656127,
"volume": 338.3194727303978,
"volume_molar": 6.366898395723242,
"formula_full": "H10 C16 S2 N2 O2",
"formula_reduced": "H5C8SNO",
"formula_anonymous": "ABCD5E8",
"energy_above_hull": 5.503247296874999,
"spacegroup": 1
},
{
"id": "jvasp-103847",
"created_at": "2022-09-04T14:36:58.383012Z",
"updated_at": "2022-09-04T14:36:58.383038Z",
"structure_string": "H3 C6 S1 N1 O2\n1.0\n3.762837 0.014676 0.724225\n0.443411 4.868445 0.514676\n-0.039192 0.032541 7.436941\nH C S N O\n3 6 1 1 2\ndirect\n0.217343 0.387698 0.242438 H\n0.154742 0.371393 0.604129 H\n0.492031 0.223574 0.902094 H\n0.346242 0.226275 0.326721 C\n0.312409 0.217744 0.520648 C\n0.493050 0.983455 0.593920 C\n0.558171 0.000615 0.256681 C\n0.530831 0.852822 0.778851 C\n0.671608 0.888505 0.078230 C\n0.703796 0.776199 0.427407 S\n0.539495 0.012797 0.920694 N\n0.569122 0.597931 0.798004 O\n0.876692 0.675391 0.070174 O\n",
"nsites": 13,
"nelements": 5,
"elements": [
"H",
"C",
"S",
"N",
"O"
],
"chemical_system": "C-H-N-O-S",
"density": 1.8662617880669399,
"density_atomic": 0.09539500997151198,
"volume": 136.27547189189684,
"volume_molar": 6.312846722064818,
"formula_full": "H3 C6 S1 N1 O2",
"formula_reduced": "H3C6SNO2",
"formula_anonymous": "ABC2D3E6",
"energy_above_hull": 5.256588480769231,
"spacegroup": 1
},
{
"id": "jvasp-103846",
"created_at": "2022-09-04T14:36:59.005971Z",
"updated_at": "2022-09-04T14:36:59.005985Z",
"structure_string": "H5 C7 S1 N1 O1\n1.0\n4.812147 -0.131311 1.997918\n0.914586 4.756842 0.808700\n0.035565 0.165097 7.449648\nH C S N O\n5 7 1 1 1\ndirect\n0.545158 0.634868 0.651694 H\n0.552946 0.350654 0.231300 H\n0.367305 0.134838 0.579047 H\n0.734193 0.857497 0.307864 H\n0.970529 0.088929 0.855155 H\n0.232061 0.288442 0.515449 C\n0.334356 0.404474 0.326643 C\n0.937776 0.360460 0.640449 C\n0.152034 0.608095 0.244408 C\n0.764089 0.579716 0.558394 C\n0.866892 0.700237 0.371101 C\n0.222984 0.682276 0.030749 C\n0.382433 0.936316 0.059204 S\n0.824693 0.240963 0.818246 N\n0.159082 0.616671 0.905503 O\n",
"nsites": 15,
"nelements": 5,
"elements": [
"H",
"C",
"S",
"N",
"O"
],
"chemical_system": "C-H-N-O-S",
"density": 1.4703701349584957,
"density_atomic": 0.08785330813443612,
"volume": 170.73915961191227,
"volume_molar": 6.854768349513618,
"formula_full": "H5 C7 S1 N1 O1",
"formula_reduced": "H5C7SNO",
"formula_anonymous": "ABCD5E7",
"energy_above_hull": 5.349849116666666,
"spacegroup": 1
},
{
"id": "jvasp-103845",
"created_at": "2022-09-04T14:37:02.370692Z",
"updated_at": "2022-09-04T14:37:02.370708Z",
"structure_string": "H5 C7 N1 O2\n1.0\n3.821852 -0.072859 -0.054867\n-0.513995 5.444696 -1.777935\n0.099294 -0.035188 6.841616\nH C N O\n5 7 1 2\ndirect\n0.737525 0.258988 0.607455 H\n0.223328 0.807718 0.274790 H\n0.311350 0.938395 0.659394 H\n0.611864 0.115411 0.226384 H\n0.736734 0.605198 0.923039 H\n0.393809 0.765144 0.561859 C\n0.342234 0.690267 0.347795 C\n0.526965 0.606736 0.654191 C\n0.407883 0.451982 0.229854 C\n0.625372 0.377681 0.533225 C\n0.557522 0.297656 0.322559 C\n0.240774 0.336263 0.022147 C\n0.518151 0.667650 0.875948 N\n0.219536 0.465845 0.886635 O\n0.075992 0.130637 0.969927 O\n",
"nsites": 15,
"nelements": 4,
"elements": [
"H",
"C",
"N",
"O"
],
"chemical_system": "C-H-N-O",
"density": 1.5810636615748839,
"density_atomic": 0.10569916604356432,
"volume": 141.91218872831686,
"volume_molar": 5.697434507210731,
"formula_full": "H5 C7 N1 O2",
"formula_reduced": "H5C7NO2",
"formula_anonymous": "AB2C5D7",
"energy_above_hull": 5.383422016666667,
"spacegroup": 1
}
]
}