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{
"id": "jvasp-29727",
"created_at": "2022-09-04T14:37:56.881482Z",
"updated_at": "2022-09-04T14:37:56.881507Z",
"structure_string": "Fe2 P2 H10 C2 O8\n1.0\n4.648983 -0.029304 -0.000177\n-0.034807 5.481228 0.000302\n-0.000540 0.000805 8.379631\nFe P H C O\n2 2 10 2 8\ndirect\n0.749477 0.506896 0.012013 Fe\n0.249478 0.006899 0.987996 Fe\n0.667586 0.005285 0.193083 P\n0.167487 0.505359 0.806922 P\n0.182522 0.622026 0.183939 H\n0.157785 0.663812 0.539475 H\n0.659170 0.162704 0.460835 H\n0.336350 -0.003533 0.410457 H\n0.600831 0.841658 0.795843 H\n0.161948 0.337311 0.543327 H\n0.682482 0.122008 0.816052 H\n0.836138 0.495802 0.589592 H\n0.101060 0.341632 0.204099 H\n0.661091 0.836179 0.456350 H\n0.571932 0.000086 0.400357 C\n0.071715 0.500480 0.599653 C\n0.518375 0.007322 0.799324 O\n0.521769 0.230831 0.110910 O\n0.018492 0.507256 0.200658 O\n0.021723 0.730852 0.889124 O\n0.018235 0.278023 0.889966 O\n0.494677 0.511599 0.818580 O\n0.994772 0.011525 0.181424 O\n0.518294 0.778011 0.110016 O\n",
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{
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"structure_string": "Li4 Mn2 Ni3 O10\n1.0\n5.027103 0.004413 0.055797\n-0.962576 4.946080 -0.040393\n-2.391293 -2.054540 6.783140\nLi Mn Ni O\n4 2 3 10\ndirect\n0.083748 0.769426 0.591203 Li\n0.697525 0.598619 0.223321 Li\n0.302474 0.401381 0.776680 Li\n0.916252 0.230573 0.408798 Li\n0.297318 0.897989 0.308797 Mn\n0.702681 0.102010 0.691204 Mn\n0.500000 -0.000000 0.000000 Ni\n0.896162 0.697611 0.897531 Ni\n0.103838 0.302389 0.102469 Ni\n0.712270 0.320428 0.948488 O\n0.466530 0.222158 0.225961 O\n0.899728 0.438409 0.668539 O\n0.100271 0.561591 0.331461 O\n0.927309 0.939620 0.150996 O\n0.287729 0.679572 0.051512 O\n0.683485 0.889798 0.449165 O\n0.316515 0.110202 0.550836 O\n0.533469 0.777842 0.774040 O\n0.072691 0.060380 0.849005 O\n",
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{
"id": "jvasp-46516",
"created_at": "2022-09-04T14:38:29.417124Z",
"updated_at": "2022-09-04T14:38:29.417154Z",
"structure_string": "Li5 Mn1 O5\n1.0\n4.002606 -0.000187 0.000124\n-2.001085 4.616548 0.008527\n-0.000063 -1.804726 5.293765\nLi Mn O\n5 1 5\ndirect\n0.682614 0.361501 0.876676 Li\n0.696925 0.392892 0.348740 Li\n0.292119 0.583274 0.681846 Li\n0.309175 0.614636 0.153886 Li\n0.008252 0.988075 0.515284 Li\n0.945733 0.988079 0.015286 Mn\n0.145327 0.272486 0.847556 O\n0.513667 0.988069 0.015287 O\n0.154542 0.298156 0.327151 O\n0.844474 0.677993 0.703416 O\n0.860901 0.703657 0.183009 O\n",
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{
"id": "jvasp-101908",
"created_at": "2022-09-04T14:37:11.896775Z",
"updated_at": "2022-09-04T14:37:11.896796Z",
"structure_string": "Zn1 H6 C5 O4\n1.0\n4.404517 -0.019162 -0.533651\n-2.055420 4.372238 0.478473\n-0.125195 0.093724 7.428652\nZn H C O\n1 6 5 4\ndirect\n0.033732 0.742275 0.268011 Zn\n0.241986 0.390210 0.647170 H\n0.017490 0.010250 0.573317 H\n0.520138 0.907111 0.750352 H\n0.881971 0.478928 0.808146 H\n0.218463 0.921081 0.876503 H\n0.586437 0.457746 0.948895 H\n0.495269 0.269303 0.466970 C\n0.266996 0.185136 0.617446 C\n0.419515 0.060078 0.789570 C\n0.692607 0.318668 0.897490 C\n0.882586 0.218803 0.056482 C\n0.732832 0.541074 0.462669 O\n0.463780 0.069159 0.359625 O\n0.835205 0.938679 0.070284 O\n0.092399 0.415431 0.165573 O\n",
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{
"id": "jvasp-57680",
"created_at": "2022-09-04T14:38:34.518156Z",
"updated_at": "2022-09-04T14:38:34.518184Z",
"structure_string": "Rh4 N12\n1.0\n5.371854 -0.000000 -1.899238\n-2.685927 4.652162 -1.899238\n0.000000 0.000000 5.697712\nRh N\n4 12\ndirect\n0.500000 0.000000 -0.000000 Rh\n-0.000000 -0.000000 0.500000 Rh\n-0.000000 0.500000 -0.000000 Rh\n0.499999 0.500000 0.499999 Rh\n0.506706 0.888418 0.618288 N\n0.270129 0.888418 0.381710 N\n0.729870 0.111581 0.618288 N\n0.111581 0.381711 0.493293 N\n0.493293 0.111581 0.381710 N\n0.111581 0.618289 0.729870 N\n0.381710 0.270129 0.888418 N\n0.888417 0.618289 0.506706 N\n0.618288 0.729870 0.111580 N\n0.888418 0.381711 0.270128 N\n0.618288 0.506707 0.888417 N\n0.381710 0.493293 0.111581 N\n",
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{
"id": "jvasp-104959",
"created_at": "2022-09-04T14:36:51.018433Z",
"updated_at": "2022-09-04T14:36:51.018454Z",
"structure_string": "H4 Pd3\n1.0\n3.009023 -0.000000 0.000000\n0.000000 3.009023 0.000000\n0.000000 -0.000000 6.881932\nH Pd\n4 3\ndirect\n0.500000 0.000000 0.094534 H\n0.500000 0.000000 0.672538 H\n-0.000000 0.500000 0.094534 H\n-0.000000 0.500000 0.672538 H\n0.000000 0.000000 0.931423 Pd\n0.000000 0.000000 0.534855 Pd\n0.500000 0.500000 0.249578 Pd\n",
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},
{
"id": "jvasp-32180",
"created_at": "2022-09-04T14:37:37.019787Z",
"updated_at": "2022-09-04T14:37:37.019808Z",
"structure_string": "Mg1 Te1 H12 O9\n1.0\n5.907928 -0.055939 -0.811757\n-0.923354 5.835593 -0.811757\n-0.048245 -0.055939 5.963239\nMg Te H O\n1 1 12 9\ndirect\n0.002920 0.002920 0.002920 Mg\n0.553498 0.553497 0.553497 Te\n0.031877 0.538887 0.957494 H\n0.957494 0.031877 0.538887 H\n0.632232 0.737366 0.127389 H\n0.127389 0.632231 0.737366 H\n0.175994 0.814577 0.384352 H\n0.422807 0.283153 0.080178 H\n0.080178 0.422807 0.283153 H\n0.283153 0.080178 0.422807 H\n0.384352 0.175993 0.814577 H\n0.814578 0.384352 0.175993 H\n0.737366 0.127389 0.632231 H\n0.538888 0.957494 0.031877 H\n0.141822 0.965205 0.340101 O\n0.965206 0.340101 0.141821 O\n0.340101 0.141821 0.965206 O\n0.874680 0.050635 0.672253 O\n0.050634 0.672253 0.874680 O\n0.672254 0.874679 0.050634 O\n0.501580 0.239302 0.589791 O\n0.239303 0.589791 0.501580 O\n0.589792 0.501580 0.239302 O\n",
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{
"id": "jvasp-55327",
"created_at": "2022-09-04T14:36:53.079426Z",
"updated_at": "2022-09-04T14:36:53.079438Z",
"structure_string": "Li12 Co2 O8\n1.0\n6.506969 0.000000 0.000000\n0.000000 6.506969 -0.000000\n0.000000 0.000000 4.625776\nLi Co O\n12 2 8\ndirect\n0.717705 0.282295 0.500000 Li\n0.000000 0.500000 0.953840 Li\n0.500000 0.000000 0.546161 Li\n0.500000 0.000000 0.046161 Li\n0.217705 0.782295 0.000000 Li\n0.282295 0.282295 0.500000 Li\n0.000000 0.500000 0.453840 Li\n0.782295 0.217705 0.000000 Li\n0.282295 0.717705 0.500000 Li\n0.217705 0.217705 0.000000 Li\n0.782295 0.782295 0.000000 Li\n0.717705 0.717705 0.500000 Li\n0.500000 0.500000 0.000000 Co\n0.000000 0.000000 0.500000 Co\n0.235520 0.500000 0.215349 O\n0.000000 0.735520 0.715349 O\n0.000000 0.264480 0.715349 O\n0.264480 0.000000 0.284652 O\n0.500000 0.235520 0.784652 O\n0.500000 0.764480 0.784652 O\n0.764480 0.500000 0.215349 O\n0.735520 0.000000 0.284652 O\n",
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{
"id": "jvasp-9957",
"created_at": "2022-09-04T14:37:18.078036Z",
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"structure_string": "Zn2 Co4 O8\n1.0\n2.836784 0.000000 0.000000\n-1.418392 4.637975 -0.000000\n0.000000 -0.000000 9.473232\nZn Co O\n2 4 8\ndirect\n0.393477 0.786956 0.750000 Zn\n0.606522 0.213045 0.250000 Zn\n0.864378 0.728758 0.069831 Co\n0.135622 0.271243 0.930168 Co\n0.864378 0.728758 0.430169 Co\n0.135622 0.271243 0.569831 Co\n0.232083 0.464167 0.391485 O\n0.767916 0.535834 0.608515 O\n0.767916 0.535834 0.891485 O\n0.232083 0.464167 0.108515 O\n0.955223 0.910449 0.250000 O\n0.044776 0.089552 0.750000 O\n0.499999 0.000000 0.000000 O\n0.499999 0.000000 0.500000 O\n",
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{
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"structure_string": "Al10 H2 O16\n1.0\n2.871254 -4.973159 -0.000000\n2.871254 4.973159 -0.000000\n-0.000000 0.000000 8.729250\nAl H O\n10 2 16\ndirect\n0.826506 0.653013 0.121982 Al\n0.666666 0.333332 0.452890 Al\n0.666666 0.333332 0.826768 Al\n0.333332 0.666666 0.326768 Al\n0.653013 0.826506 0.621982 Al\n0.333332 0.666666 0.952890 Al\n0.173492 0.346985 0.621982 Al\n0.346985 0.173492 0.121982 Al\n0.826507 0.173492 0.121982 Al\n0.173492 0.826507 0.621982 Al\n0.000000 0.000000 0.138427 H\n0.000000 0.000000 0.638427 H\n0.170253 0.340507 0.220481 O\n0.340507 0.170253 0.720481 O\n0.829746 0.170253 0.720481 O\n0.829745 0.659491 0.720481 O\n0.659491 0.829745 0.220481 O\n0.170253 0.829746 0.220481 O\n0.966756 0.483378 0.986930 O\n0.000000 0.000000 0.021395 O\n0.516621 0.033242 0.986930 O\n0.033242 0.516621 0.486930 O\n0.483378 0.516620 0.486930 O\n0.483378 0.966756 0.486930 O\n0.666666 0.333332 0.239041 O\n0.000000 0.000000 0.521395 O\n0.516620 0.483378 0.986930 O\n0.333332 0.666666 0.739041 O\n",
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},
{
"id": "jvasp-19602",
"created_at": "2022-09-04T14:38:29.599244Z",
"updated_at": "2022-09-04T14:38:29.599272Z",
"structure_string": "Be1 Ni1\n1.0\n2.611382 0.000000 -0.000000\n-0.000000 2.611382 0.000000\n0.000000 0.000000 2.611382\nBe Ni\n1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.500000 0.500000 0.500000 Ni\n",
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{
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"created_at": "2022-09-04T14:37:05.281564Z",
"updated_at": "2022-09-04T14:37:05.281591Z",
"structure_string": "Si2 H12 N4 F8\n1.0\n4.968381 0.000000 -0.533674\n0.000000 7.159268 0.000000\n-0.349797 0.000000 6.546509\nSi H N F\n2 12 4 8\ndirect\n-0.000000 0.500000 0.500000 Si\n0.000000 0.000000 0.000000 Si\n0.229830 0.830011 0.310025 H\n0.770170 0.169990 0.689976 H\n0.229829 0.669990 0.810025 H\n0.208677 0.060415 0.357381 H\n0.791323 0.560415 0.142620 H\n0.770170 0.330011 0.189976 H\n0.208677 0.439585 0.857381 H\n0.443516 0.980690 0.223293 H\n0.556484 0.480690 0.276707 H\n0.556484 0.019310 0.776707 H\n0.443515 0.519311 0.723293 H\n0.791322 0.939585 0.642620 H\n0.246967 0.962117 0.250268 N\n0.753033 0.462117 0.249733 N\n0.246966 0.537884 0.750268 N\n0.753032 0.037884 0.749733 N\n0.243854 0.571122 0.358610 F\n0.113921 0.274797 0.497534 F\n0.886079 0.774798 0.002466 F\n0.886079 0.725203 0.502466 F\n0.113920 0.225203 0.997534 F\n0.756145 0.428878 0.641391 F\n0.243854 0.928878 0.858610 F\n0.756145 0.071122 0.141391 F\n",
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}
]
}