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{
"id": "jvasp-56219",
"created_at": "2022-09-04T14:37:31.069343Z",
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"structure_string": "Li2 B12 C2\n1.0\n4.705272 0.000000 0.000000\n0.000000 4.778230 -2.307395\n0.000000 0.002127 5.306180\nLi B C\n2 12 2\ndirect\n0.500000 0.527744 0.115734 Li\n0.500000 0.115734 0.527744 Li\n0.817349 0.257618 0.257618 B\n0.693666 0.901523 0.097929 B\n0.693666 0.097928 0.901523 B\n0.183207 0.743118 0.743118 B\n0.000000 0.332613 0.993243 B\n0.306333 0.097928 0.901523 B\n0.000000 0.007513 0.668909 B\n0.000000 0.993243 0.332614 B\n0.306333 0.901523 0.097929 B\n0.182650 0.257618 0.257618 B\n0.000000 0.668909 0.007513 B\n0.816793 0.743118 0.743118 B\n0.646267 0.501638 0.501638 C\n0.353733 0.501638 0.501638 C\n",
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"structure_string": "Mg1 V4 O10\n1.0\n3.569148 0.672202 -0.000065\n0.843352 5.256382 -0.000014\n-0.000135 -0.000233 11.312322\nMg V O\n1 4 10\ndirect\n0.379417 0.218530 0.750001 Mg\n0.283993 0.409764 0.101491 V\n0.691068 0.597356 0.900784 V\n0.691062 0.597360 0.599218 V\n0.283984 0.409775 0.398515 V\n0.790661 0.397258 0.750001 O\n0.222735 0.533384 0.249998 O\n0.733085 0.512532 0.065485 O\n0.248134 0.482316 0.917005 O\n0.733079 0.512546 0.434517 O\n0.248129 0.482327 0.582997 O\n0.441409 0.091768 0.384244 O\n0.530906 0.919669 0.628811 O\n0.530908 0.919665 0.871192 O\n0.441419 0.091759 0.115765 O\n",
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{
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"structure_string": "Ce1 Ni1 C2\n1.0\n3.784945 0.019849 0.000000\n-1.093440 3.623616 0.000000\n0.000000 0.000000 3.792612\nCe Ni C\n1 1 2\ndirect\n0.992521 0.007478 0.000000 Ce\n0.599814 0.400186 0.500000 Ni\n0.442144 0.862882 0.500000 C\n0.137119 0.557856 0.500000 C\n",
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{
"id": "jvasp-579",
"created_at": "2022-09-04T14:37:34.310375Z",
"updated_at": "2022-09-04T14:37:34.310402Z",
"structure_string": "Nb1 S2\n1.0\n-3.162864 0.001759 -0.005274\n-0.001809 -3.362035 0.007053\n1.571462 0.012558 5.654081\nNb S\n1 2\ndirect\n0.022191 0.171602 0.043423 Nb\n0.362333 0.171545 0.723453 S\n0.622171 0.671674 0.243375 S\n",
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{
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"created_at": "2022-09-04T14:37:38.606125Z",
"updated_at": "2022-09-04T14:37:38.606145Z",
"structure_string": "Li5 P1 S4 Cl2\n1.0\n0.000000 0.000000 -5.927445\n0.000000 -5.192633 2.963723\n-7.151625 0.000000 0.000000\nLi P S Cl\n5 1 4 2\ndirect\n0.300201 0.383445 0.754393 Li\n0.916756 0.616554 0.245607 Li\n0.300201 0.383445 0.245607 Li\n0.916756 0.616554 0.754393 Li\n0.620635 0.000000 0.500000 Li\n0.564395 0.000000 0.000000 P\n0.931076 0.322686 0.000000 S\n0.608389 0.677313 0.000000 S\n0.361074 0.000000 0.764812 S\n0.361074 0.000000 0.235187 S\n0.680851 0.648439 0.500000 Cl\n0.032411 0.351560 0.500000 Cl\n",
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{
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"created_at": "2022-09-04T14:37:49.721201Z",
"updated_at": "2022-09-04T14:37:49.721222Z",
"structure_string": "Na2 Ca2 C3 O9\n1.0\n4.981905 0.000000 0.000000\n0.000000 5.970168 -2.735072\n0.000000 -0.023104 6.566808\nNa Ca C O\n2 2 3 9\ndirect\n0.000000 0.925701 0.925701 Na\n0.500000 0.615482 0.615482 Na\n0.500000 0.212095 0.780186 Ca\n0.500000 0.780186 0.212094 Ca\n0.000000 0.876630 0.464228 C\n0.000000 0.464229 0.876630 C\n0.500000 0.224895 0.224895 C\n0.500000 0.414422 0.210230 O\n0.500000 0.210230 0.414422 O\n0.000000 0.885012 0.271780 O\n0.500000 0.038409 0.038409 O\n0.000000 0.271780 0.885012 O\n0.226495 0.869460 0.559061 O\n0.773506 0.559061 0.869460 O\n0.773506 0.869460 0.559061 O\n0.226495 0.559061 0.869460 O\n",
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"formula_full": "Na2 Ca2 C3 O9",
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{
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"created_at": "2022-09-04T14:37:50.729975Z",
"updated_at": "2022-09-04T14:37:50.730002Z",
"structure_string": "Pu1 Ni1 C2\n1.0\n3.638631 0.000000 0.000000\n0.000000 2.268427 3.035086\n0.000000 -2.268427 3.035086\nPu Ni C\n1 1 2\ndirect\n0.000000 0.000306 0.000306 Pu\n0.500000 0.609935 0.609935 Ni\n0.500000 0.454532 0.150229 C\n0.500000 0.150229 0.454532 C\n",
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{
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"created_at": "2022-09-04T14:37:52.972071Z",
"updated_at": "2022-09-04T14:37:52.972085Z",
"structure_string": "Te6 Mo6 S6\n1.0\n-1.514512 3.023231 0.000000\n-0.000002 -0.000007 -13.856129\n-7.050825 -5.423468 -0.000003\nTe Mo S\n6 6 6\ndirect\n0.106058 0.114775 0.212131 Te\n0.781946 0.116173 0.563908 Te\n0.222152 0.618610 0.444290 Te\n0.222151 0.881390 0.444290 Te\n0.781947 0.383825 0.563908 Te\n0.106058 0.385225 0.212131 Te\n0.786723 0.750000 0.573409 Mo\n0.894904 0.250000 0.789815 Mo\n0.445730 0.750000 0.891445 Mo\n0.548250 0.250000 0.096516 Mo\n0.103197 0.750000 0.206385 Mo\n0.221382 0.250000 0.442798 Mo\n0.552508 0.639050 0.105024 S\n0.894083 0.860945 0.788148 S\n0.894082 0.639055 0.788148 S\n0.443156 0.138301 0.886317 S\n0.552508 0.860950 0.105024 S\n0.443156 0.361699 0.886317 S\n",
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{
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"created_at": "2022-09-04T14:37:52.913369Z",
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"structure_string": "Pr2 Cu1 Si3 Rh2\n1.0\n8.815481 0.028685 0.000000\n-7.795927 4.115463 0.000000\n0.000000 0.000000 4.125782\nPr Cu Si Rh\n2 1 3 2\ndirect\n0.895238 0.104764 -0.000000 Pr\n0.109445 0.890554 0.500000 Pr\n0.668303 0.331698 -0.000000 Cu\n0.317753 0.682247 0.500000 Si\n0.535386 0.464615 -0.000000 Si\n0.463014 0.536986 0.500000 Si\n0.254826 0.745173 -0.000000 Rh\n0.756035 0.243966 0.500000 Rh\n",
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{
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"structure_string": "Y1 Tc1 N3\n1.0\n0.000000 3.503960 1.893529\n4.042179 0.000000 0.000000\n0.000000 3.503857 -2.295069\nY Tc N\n1 1 3\ndirect\n0.831170 0.500000 0.337660 Y\n0.524008 0.000000 0.951985 Tc\n0.412952 0.000000 0.511163 N\n0.075886 0.000000 0.511163 N\n0.510565 0.500000 0.978870 N\n",
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{
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"structure_string": "Ba1 Zr1 Se3\n1.0\n5.257269 -0.001632 -0.003318\n0.001912 5.264279 -0.002774\n0.004540 0.007212 5.267448\nBa Zr Se\n1 1 3\ndirect\n0.987338 0.995755 0.992104 Ba\n0.487116 0.490813 0.486954 Zr\n0.488975 0.998977 0.506305 Se\n0.987951 0.508235 0.507776 Se\n0.488615 0.506220 0.996867 Se\n",
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{
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"created_at": "2022-09-04T14:37:59.305113Z",
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"structure_string": "Li1 Bi3 Cl2 O4\n1.0\n6.634985 0.045503 0.000000\n-4.394194 4.971534 0.000000\n-0.000000 -0.000000 5.487204\nLi Bi Cl O\n1 3 2 4\ndirect\n0.696080 0.303919 0.500000 Li\n0.149609 0.850390 -0.000000 Bi\n0.841144 0.158855 -0.000000 Bi\n0.345352 0.654646 0.500000 Bi\n0.495357 0.504642 -0.000000 Cl\n0.987017 0.012981 0.500000 Cl\n0.494235 0.001518 0.750739 O\n-0.001518 0.505764 0.249260 O\n-0.001518 0.505764 0.750739 O\n0.494235 0.001518 0.249260 O\n",
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