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{
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"results": [
{
"id": "mp-1095908",
"created_at": "2022-09-04T14:48:24.178546Z",
"structure_string": "Ca2 Cu1 Pd1\n1.0\n-5.413710 5.947556 8.405684\n5.413710 -5.947556 8.405684\n5.413710 5.947556 -8.405684\nCa Cu Pd\n2 1 1\ndirect\n0.000000 0.262346 0.262346 Ca\n0.000000 0.737654 0.737654 Ca\n0.000000 0.000000 0.000000 Cu\n0.000000 0.500000 0.500000 Pd\n",
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{
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"structure_string": "Mg8 Si14\n1.0\n6.655906 -0.014234 -1.702771\n-0.068694 3.935900 -0.660417\n0.187423 0.117502 14.941141\nMg Si\n8 14\ndirect\n0.765950 0.850774 0.065440 Mg\n0.644878 0.103732 0.493742 Mg\n0.881981 0.672957 0.648809 Mg\n0.389011 0.519844 0.342271 Mg\n0.277160 0.898350 0.157447 Mg\n0.653664 0.239308 0.897209 Mg\n0.382964 0.669800 0.580778 Mg\n0.918016 0.560117 0.421026 Mg\n0.402995 0.319253 0.035514 Si\n0.037788 0.354588 0.037630 Si\n0.344995 0.760801 0.935273 Si\n0.975766 0.764243 0.904216 Si\n0.241958 0.078567 0.445701 Si\n0.048721 0.124215 0.560000 Si\n0.948715 0.218651 0.796380 Si\n0.998271 0.422931 0.196862 Si\n0.657738 0.987740 0.299591 Si\n0.423202 0.670110 0.778012 Si\n0.621407 0.238787 0.692268 Si\n0.631983 0.421201 0.190797 Si\n0.021556 0.975786 0.296339 Si\n0.227631 0.151888 0.721068 Si\n",
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},
{
"id": "mp-770274",
"created_at": "2022-09-04T14:48:24.179087Z",
"structure_string": "Ni4 P16\n1.0\n5.302024 2.603158 0.000000\n-5.302024 2.603158 0.000000\n0.000000 0.648117 11.312728\nNi P\n4 16\ndirect\n0.000000 0.500000 0.000000 Ni\n0.919083 0.080917 0.250000 Ni\n0.500000 0.000000 0.500000 Ni\n0.080917 0.919083 0.750000 Ni\n0.927119 0.452234 0.789335 P\n0.761464 0.625166 0.285201 P\n0.661942 0.466120 0.476678 P\n0.949793 0.139404 0.452323 P\n0.860596 0.050207 0.047677 P\n0.533880 0.338058 0.023322 P\n0.547766 0.072881 0.710665 P\n0.374834 0.238536 0.214799 P\n0.625166 0.761464 0.785201 P\n0.452234 0.927119 0.289335 P\n0.466120 0.661942 0.976678 P\n0.139404 0.949793 0.952323 P\n0.050207 0.860596 0.547677 P\n0.338058 0.533880 0.523322 P\n0.238536 0.374834 0.714799 P\n0.072881 0.547766 0.210665 P\n",
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"volume": 312.2766838041175,
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"formula_full": "Ni4 P16",
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"updated_at": "2021-11-28T01:39:32.232000Z",
"spacegroup": 15
},
{
"id": "mp-1229317",
"created_at": "2022-09-04T14:48:24.201368Z",
"structure_string": "Cd6 H72 C20 N10 Cl22\n1.0\n5.762105 -9.118571 0.000000\n5.762105 9.118571 0.000000\n0.000000 0.000000 15.922102\nCd H C N Cl\n6 72 20 10 22\ndirect\n0.026279 0.026279 0.249794 Cd\n0.973721 0.973721 0.749794 Cd\n0.201252 0.401102 0.248810 Cd\n0.598898 0.798748 0.748810 Cd\n0.798748 0.598898 0.748810 Cd\n0.401102 0.201252 0.248810 Cd\n0.082484 0.705354 0.577782 H\n0.294552 0.917454 0.422221 H\n0.082546 0.705448 0.922221 H\n0.294646 0.917516 0.077782 H\n0.917454 0.294552 0.422221 H\n0.705354 0.082484 0.577782 H\n0.917516 0.294646 0.077782 H\n0.705448 0.082546 0.922221 H\n0.708435 0.407670 0.249774 H\n0.592330 0.291565 0.749774 H\n0.291565 0.592330 0.749774 H\n0.407670 0.708435 0.249774 H\n0.492454 0.395719 0.420873 H\n0.588725 0.490438 0.557454 H\n0.509562 0.411275 0.057454 H\n0.604281 0.507546 0.920873 H\n0.490438 0.588725 0.557454 H\n0.395719 0.492454 0.420873 H\n0.507546 0.604281 0.920873 H\n0.411275 0.509562 0.057454 H\n0.071620 0.898104 0.449341 H\n0.101934 0.928484 0.550643 H\n0.071516 0.898066 0.050643 H\n0.101896 0.928380 0.949341 H\n0.928484 0.101934 0.550643 H\n0.898104 0.071620 0.449341 H\n0.928380 0.101896 0.949341 H\n0.898066 0.071516 0.050643 H\n0.818388 0.472457 0.382229 H\n0.527540 0.181771 0.617801 H\n0.818229 0.472460 0.117801 H\n0.527543 0.181612 0.882229 H\n0.181771 0.527540 0.617801 H\n0.472457 0.818388 0.382229 H\n0.181612 0.527543 0.882229 H\n0.472460 0.818229 0.117801 H\n0.978523 0.574255 0.330032 H\n0.425793 0.021383 0.669884 H\n0.978617 0.574207 0.169884 H\n0.425745 0.021477 0.830032 H\n0.021383 0.425793 0.669884 H\n0.574255 0.978523 0.330032 H\n0.021477 0.425745 0.830032 H\n0.574207 0.978617 0.169884 H\n0.087509 0.674282 0.466958 H\n0.325644 0.912275 0.533112 H\n0.087725 0.674356 0.033112 H\n0.325718 0.912491 0.966958 H\n0.912275 0.325644 0.533112 H\n0.674282 0.087509 0.466958 H\n0.912491 0.325718 0.966958 H\n0.674356 0.087725 0.033112 H\n0.943786 0.693531 0.512772 H\n0.306336 0.055941 0.487305 H\n0.944059 0.693664 0.987305 H\n0.306469 0.056214 0.012772 H\n0.055941 0.306336 0.487305 H\n0.693531 0.943786 0.512772 H\n0.056214 0.306469 0.012772 H\n0.693664 0.944059 0.987305 H\n0.843733 0.373181 0.249950 H\n0.626819 0.156267 0.749950 H\n0.156267 0.626819 0.749950 H\n0.373181 0.843733 0.249950 H\n0.839489 0.624217 0.325360 H\n0.375890 0.160722 0.674545 H\n0.839278 0.624110 0.174545 H\n0.375783 0.160511 0.825360 H\n0.160722 0.375890 0.674545 H\n0.624217 0.839489 0.325360 H\n0.160511 0.375783 0.825360 H\n0.624110 0.839278 0.174545 H\n0.457289 0.457289 0.545026 C\n0.574942 0.574942 0.501446 C\n0.425058 0.425058 0.001446 C\n0.542711 0.542711 0.045026 C\n0.866462 0.537341 0.327738 C\n0.462545 0.133436 0.672192 C\n0.866564 0.537455 0.172192 C\n0.462659 0.133538 0.827738 C\n0.133436 0.462545 0.672192 C\n0.537341 0.866462 0.327738 C\n0.133538 0.462659 0.827738 C\n0.537455 0.866564 0.172192 C\n0.054886 0.726842 0.515066 C\n0.273079 0.944886 0.484988 C\n0.055114 0.726921 0.984988 C\n0.273158 0.945114 0.015066 C\n0.944886 0.273079 0.484988 C\n0.726842 0.054886 0.515066 C\n0.945114 0.273158 0.015066 C\n0.726921 0.055114 0.984988 C\n0.814966 0.454291 0.249948 N\n0.545709 0.185034 0.749948 N\n0.185034 0.545709 0.749948 N\n0.454291 0.814966 0.249948 N\n0.121763 0.878147 0.500005 N\n0.121853 0.878237 0.000005 N\n0.878147 0.121763 0.500005 N\n0.878237 0.121853 0.000005 N\n0.466205 0.466205 0.452250 N\n0.533795 0.533795 0.952250 N\n0.481353 0.481353 0.251543 Cl\n0.518647 0.518647 0.751543 Cl\n0.929971 0.228143 0.250372 Cl\n0.771857 0.070029 0.750372 Cl\n0.070029 0.771857 0.750372 Cl\n0.228143 0.929971 0.250372 Cl\n0.204978 0.204978 0.140798 Cl\n0.792708 0.792708 0.861956 Cl\n0.207292 0.207292 0.361956 Cl\n0.795022 0.795022 0.640798 Cl\n0.888954 0.888954 0.374497 Cl\n0.111759 0.111759 0.624678 Cl\n0.888241 0.888241 0.124678 Cl\n0.111046 0.111046 0.874497 Cl\n0.228923 0.560857 0.374523 Cl\n0.437415 0.773669 0.626228 Cl\n0.226331 0.562585 0.126228 Cl\n0.439143 0.771077 0.874523 Cl\n0.773669 0.437415 0.626228 Cl\n0.560857 0.228923 0.374523 Cl\n0.771077 0.439143 0.874523 Cl\n0.562585 0.226331 0.126228 Cl\n",
"nsites": 130,
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"elements": [
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"H",
"C",
"N",
"Cl"
],
"chemical_system": "C-Cd-Cl-H-N",
"density": 1.8928938859549471,
"density_atomic": 0.07769713463841407,
"volume": 1673.1633747498197,
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"formula_full": "Cd6 H72 C20 N10 Cl22",
"formula_reduced": "Cd3H36C10N5Cl11",
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"spacegroup": 36
},
{
"id": "mp-30389",
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"structure_string": "Ho1 Pb1 Au1\n1.0\n0.000000 3.415303 3.415303\n3.415303 0.000000 3.415303\n3.415303 3.415303 0.000000\nHo Pb Au\n1 1 1\ndirect\n0.500000 0.500000 0.500000 Ho\n0.000000 0.000000 0.000000 Pb\n0.250000 0.250000 0.250000 Au\n",
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{
"id": "mp-1074203",
"created_at": "2022-09-04T14:48:24.215548Z",
"structure_string": "Mg8 Si14\n1.0\n2.211967 14.602905 0.000000\n-2.211967 14.602905 0.000000\n0.000000 0.042379 5.687943\nMg Si\n8 14\ndirect\n0.584987 0.584987 0.201055 Mg\n0.771888 0.771888 0.450711 Mg\n0.327506 0.327506 0.204094 Mg\n0.216421 0.216421 0.700751 Mg\n0.590991 0.590991 0.703362 Mg\n0.955350 0.955350 0.214999 Mg\n0.321883 0.321883 0.709794 Mg\n0.221122 0.221122 0.195279 Mg\n0.043794 0.043794 0.463311 Si\n0.041935 0.041935 0.943716 Si\n0.499413 0.499413 0.492872 Si\n0.499720 0.499720 0.927458 Si\n0.770899 0.770899 0.951958 Si\n0.867722 0.867722 0.943664 Si\n0.411021 0.411021 0.928119 Si\n0.131805 0.131805 0.961305 Si\n0.673854 0.673854 0.424007 Si\n0.869642 0.869642 0.464750 Si\n0.411496 0.411496 0.485168 Si\n0.131685 0.131685 0.440417 Si\n0.676209 0.676209 0.977162 Si\n0.953215 0.953215 0.719740 Si\n",
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{
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"structure_string": "Tl1 Cu2 Se2\n1.0\n-1.934549 1.934549 7.206564\n1.934549 -1.934549 7.206564\n1.934549 1.934549 -7.206564\nTl Cu Se\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Tl\n0.750000 0.250000 0.500000 Cu\n0.250000 0.750000 0.500000 Cu\n0.643001 0.643001 0.000000 Se\n0.356999 0.356999 0.000000 Se\n",
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{
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"structure_string": "Dy2 N6 O30\n1.0\n6.971851 0.255706 0.100532\n3.608209 7.855057 3.205611\n-0.012744 0.333488 11.299441\nDy N O\n2 6 30\ndirect\n0.874450 0.642729 0.722411 Dy\n0.125550 0.357272 0.277589 Dy\n0.946134 0.832117 0.484724 N\n0.053866 0.167883 0.515276 N\n0.861099 0.718185 0.199708 N\n0.138901 0.281815 0.800292 N\n0.893649 0.850756 0.842066 N\n0.106351 0.149244 0.157934 N\n0.554472 0.636094 0.532326 O\n0.445528 0.363906 0.467674 O\n0.014637 0.375855 0.688015 O\n0.985363 0.624145 0.311985 O\n0.530273 0.685398 0.631370 O\n0.469727 0.314602 0.368630 O\n0.717136 0.891114 0.773074 O\n0.282864 0.108886 0.226926 O\n0.098485 0.694159 0.577241 O\n0.901515 0.305841 0.422759 O\n0.051832 0.698060 0.857901 O\n0.948168 0.301940 0.142099 O\n0.731132 0.870858 0.164704 O\n0.268868 0.129142 0.835296 O\n0.534732 0.639535 0.984769 O\n0.465268 0.360465 0.015231 O\n0.113469 0.369408 0.873227 O\n0.886531 0.630592 0.126773 O\n0.753742 0.862771 0.506686 O\n0.246258 0.137229 0.493314 O\n0.985265 0.922872 0.388162 O\n0.014735 0.077128 0.611838 O\n0.576549 0.256427 0.570933 O\n0.423451 0.743573 0.429067 O\n0.912561 0.944773 0.887642 O\n0.087439 0.055227 0.112358 O\n0.653706 0.365839 0.857954 O\n0.346294 0.634161 0.142046 O\n0.616247 0.275864 0.966135 O\n0.383753 0.724136 0.033865 O\n",
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{
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