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{
"id": "jvasp-96934",
"created_at": "2022-09-04T14:36:02.521308Z",
"updated_at": "2022-09-04T14:36:02.521337Z",
"structure_string": "Na4 P4 H16 O20\n1.0\n7.345215 0.000000 0.000000\n0.000000 7.563727 0.000000\n0.000000 0.000000 7.823493\nNa P H O\n4 4 16 20\ndirect\n0.981331 0.502003 0.485345 Na\n0.481331 0.997998 0.985345 Na\n0.981331 0.002003 0.014655 Na\n0.481331 0.497998 0.514654 Na\n0.746531 0.375158 0.876696 P\n0.246531 0.124842 0.376696 P\n0.746531 0.875158 0.623304 P\n0.246531 0.624842 0.123304 P\n0.458710 0.448548 0.891001 H\n0.850122 0.210538 0.658174 H\n0.850122 0.710538 0.841826 H\n0.958710 0.051453 0.391001 H\n0.209840 0.694720 0.771179 H\n0.958710 0.551453 0.108998 H\n0.722577 0.720921 0.090445 H\n0.222577 0.779079 0.590445 H\n0.722577 0.220921 0.409555 H\n0.709841 0.305280 0.228821 H\n0.222577 0.279079 0.909555 H\n0.350122 0.289462 0.158174 H\n0.350122 0.789462 0.341826 H\n0.709841 0.805281 0.271179 H\n0.209840 0.194720 0.728821 H\n0.458710 0.948548 0.608998 H\n0.733884 0.721083 0.501668 O\n0.827623 0.544552 0.954884 O\n0.864641 0.333501 0.712948 O\n0.553591 0.425368 0.797408 O\n0.364641 0.166499 0.212948 O\n0.327622 0.955449 0.454884 O\n0.211455 0.663696 0.648112 O\n0.553591 0.925368 0.702592 O\n0.233884 0.278917 0.498331 O\n0.827623 0.044552 0.545115 O\n0.053591 0.074633 0.297408 O\n0.711455 0.336304 0.351888 O\n0.733884 0.221083 -0.001668 O\n0.864641 0.833501 0.787052 O\n0.211455 0.163696 0.851887 O\n0.053591 0.574633 0.202592 O\n0.233884 0.778917 0.001668 O\n0.364641 0.666500 0.287052 O\n0.711455 0.836304 0.148112 O\n0.327622 0.455449 0.045116 O\n",
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{
"id": "jvasp-10487",
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"structure_string": "Li4 Np1 O5\n1.0\n4.003305 -0.000177 1.867408\n2.001487 4.728715 0.933614\n0.002479 -0.000101 5.219306\nLi Np O\n4 1 5\ndirect\n0.186642 0.229890 0.396842 Li\n0.583501 0.603157 0.229858 Li\n0.416499 0.396842 0.770143 Li\n0.813359 0.770109 0.603159 Li\n0.000000 0.000000 0.000000 Np\n0.500000 -0.000000 0.000000 O\n0.912508 0.375974 0.799015 O\n0.288499 0.798994 0.624026 O\n0.087493 0.624025 0.200985 O\n0.711501 0.201005 0.375975 O\n",
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"formula_full": "Li4 Np1 O5",
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{
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"updated_at": "2022-09-04T14:36:53.274885Z",
"structure_string": "H14 Br2 O6\n1.0\n6.246246 0.000000 -0.111750\n-0.099008 3.084081 5.642435\n-0.099008 -3.084081 5.642435\nH Br O\n14 2 6\ndirect\n0.454727 0.025551 0.810390 H\n0.253797 0.293745 0.037570 H\n0.367280 0.510009 0.065967 H\n0.796204 0.185318 0.344101 H\n0.744377 0.049674 0.189855 H\n0.296203 0.844102 0.685318 H\n0.035600 0.744958 0.678421 H\n0.535601 0.178421 0.244958 H\n0.753797 0.537570 0.793746 H\n0.867281 0.565967 0.010010 H\n0.104363 0.311710 0.325126 H\n0.954727 0.310390 0.525551 H\n0.604363 0.825126 0.811710 H\n0.244375 0.689856 0.549675 H\n0.498451 0.453131 0.576672 Br\n-0.001549 0.076672 0.953131 Br\n0.676717 0.080340 0.312653 O\n0.455882 0.855933 0.841216 O\n0.955883 0.341215 0.355932 O\n0.829766 0.652939 0.831767 O\n0.176716 0.812653 0.580340 O\n0.329766 0.331766 0.152938 O\n",
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{
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"structure_string": "Fe4 O4\n1.0\n3.034097 0.009362 -0.028239\n-0.032283 4.943283 -1.786841\n0.050887 0.038191 5.254289\nFe O\n4 4\ndirect\n0.500001 -0.000000 0.500000 Fe\n0.000001 0.500000 0.500000 Fe\n0.000000 0.000000 0.000000 Fe\n0.500002 0.500000 -0.000000 Fe\n0.000001 0.250009 0.750005 O\n0.500000 0.250008 0.250004 O\n0.000001 0.749991 0.249995 O\n0.500002 0.749990 0.749996 O\n",
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{
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"structure_string": "Na1 B1 C2\n1.0\n2.631803 0.000000 0.000000\n-0.000000 2.631803 -0.000000\n0.000000 0.000000 5.704300\nNa B C\n1 1 2\ndirect\n0.500000 0.500000 0.604945 Na\n0.000000 0.000000 0.056200 B\n0.000000 0.000000 0.319098 C\n0.500000 0.500000 0.029758 C\n",
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{
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"created_at": "2022-09-04T14:36:01.302718Z",
"updated_at": "2022-09-04T14:36:01.302752Z",
"structure_string": "Co2 O4\n1.0\n2.822983 0.003142 0.005203\n1.408746 2.446265 0.001390\n1.389072 0.822417 8.589574\nCo O\n2 4\ndirect\n0.003817 0.997164 -0.000766 Co\n0.503557 0.497545 0.499275 Co\n0.634664 0.627689 0.107426 O\n0.206079 0.200393 0.390978 O\n0.801039 0.794691 0.607572 O\n0.372966 0.366645 0.891033 O\n",
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{
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"created_at": "2022-09-04T14:38:46.035202Z",
"updated_at": "2022-09-04T14:38:46.035220Z",
"structure_string": "Li4 Mn2 V6 O16\n1.0\n5.030797 -0.028690 -2.874912\n-3.318999 9.521115 -0.060554\n-0.026101 0.028898 5.794263\nLi Mn V O\n4 2 6 16\ndirect\n0.122106 0.183137 0.061046 Li\n0.130653 0.695951 0.565298 Li\n0.877896 0.316867 0.438955 Li\n0.869357 0.804055 0.934708 Li\n0.499998 0.250001 0.749998 Mn\n0.499994 0.749990 0.249997 Mn\n-0.012944 -0.002161 0.493547 V\n0.012945 0.502163 0.006452 V\n0.504271 -0.002152 0.493591 V\n0.504289 -0.002160 0.010763 V\n0.495712 0.502162 0.489237 V\n0.495729 0.502155 0.006411 V\n0.262465 0.625014 0.899828 O\n0.737787 0.381792 0.644007 O\n0.737589 0.875008 0.137408 O\n0.737777 0.381784 0.093752 O\n0.737527 0.874983 0.600161 O\n0.262220 0.118214 0.406246 O\n0.262210 0.118206 0.855993 O\n0.264010 0.896079 0.632054 O\n0.711983 0.118214 0.856001 O\n0.725173 0.625014 0.362549 O\n0.735991 0.603924 0.867948 O\n0.744235 0.116378 0.372132 O\n0.274845 0.874983 0.137461 O\n0.255766 0.383625 0.127869 O\n0.262403 0.624989 0.362597 O\n0.288018 0.381785 0.644000 O\n",
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{
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"structure_string": "Fe4 O4\n1.0\n3.032430 0.056298 -0.028344\n-0.105922 4.970756 -1.707295\n0.051099 -0.047768 5.255883\nFe O\n4 4\ndirect\n0.500001 -0.000000 0.500001 Fe\n0.500001 0.500000 0.000001 Fe\n-0.000000 0.000000 -0.000001 Fe\n-0.000000 0.500000 0.499998 Fe\n0.000011 0.249995 0.750031 O\n0.500010 0.249995 0.250030 O\n-0.000009 0.750007 0.249967 O\n0.499990 0.750004 0.749970 O\n",
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{
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"structure_string": "Al1 Fe3 H1\n1.0\n3.668756 -0.000000 0.000000\n0.000000 3.668756 0.000000\n-0.000000 -0.000000 3.668756\nAl Fe H\n1 3 1\ndirect\n0.500000 0.500000 0.500000 Al\n0.500000 0.000000 -0.000000 Fe\n-0.000000 0.500000 -0.000000 Fe\n0.000000 0.000000 0.500000 Fe\n0.000000 0.000000 0.000000 H\n",
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"structure_string": "Na2 Ni2 B2 O6\n1.0\n4.998981 -0.030014 0.017618\n-2.467402 -4.349129 -0.106328\n-1.097927 -0.112435 -5.439037\nNa Ni B O\n2 2 2 6\ndirect\n0.653126 0.320331 0.746012 Na\n0.343804 0.674248 0.250688 Na\n0.998451 0.997291 0.498367 Ni\n0.998439 0.997258 0.998363 Ni\n0.323416 0.657208 0.746887 B\n0.673471 0.337355 0.249811 B\n0.128795 0.344327 0.728365 O\n0.868082 0.650234 0.268355 O\n0.627790 0.782848 0.707035 O\n0.213305 0.842014 0.806428 O\n0.783616 0.152585 0.190271 O\n0.369098 0.211704 0.289660 O\n",
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{
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{
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"structure_string": "Cr4 O6\n1.0\n4.422340 -0.021113 3.045327\n1.589282 4.126950 3.045327\n-0.030913 -0.021113 5.369371\nCr O\n4 6\ndirect\n0.850449 0.850450 0.850449 Cr\n0.649551 0.649552 0.649551 Cr\n0.149551 0.149552 0.149551 Cr\n0.350449 0.350449 0.350449 Cr\n0.051772 0.750000 0.448228 O\n0.750000 0.448228 0.051773 O\n0.448228 0.051774 0.749999 O\n0.948227 0.250001 0.551772 O\n0.551772 0.948228 0.250001 O\n0.250000 0.551774 0.948227 O\n",
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}
]
}