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{
"id": "jvasp-31893",
"created_at": "2022-09-04T14:37:56.758470Z",
"updated_at": "2022-09-04T14:37:56.758500Z",
"structure_string": "Te4 W2 Cl12\n1.0\n6.472556 0.079764 -1.533241\n-0.279866 7.601486 -1.575242\n-0.097188 -0.084849 11.467288\nTe W Cl\n4 2 12\ndirect\n0.739331 0.850819 0.494174 Te\n0.617951 0.096407 0.673664 Te\n0.260668 0.149181 0.505826 Te\n0.382048 0.903593 0.326336 Te\n0.791175 0.329147 0.195360 W\n0.208825 0.670853 0.804640 W\n0.920998 0.046976 0.217486 Cl\n0.335342 0.390238 0.818538 Cl\n0.269962 0.630150 0.608385 Cl\n0.079001 0.953024 0.782514 Cl\n0.140353 0.711366 0.995569 Cl\n0.878251 0.551895 0.716977 Cl\n0.664657 0.609762 0.181463 Cl\n0.467129 0.202862 0.111917 Cl\n0.859647 0.288634 0.004432 Cl\n0.730038 0.369850 0.391616 Cl\n0.532871 0.797138 0.888084 Cl\n0.121748 0.448106 0.283023 Cl\n",
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{
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"structure_string": "K4 Mn6 S8\n1.0\n5.934593 0.000000 0.000000\n0.000000 6.903280 -2.072238\n0.000000 0.002163 10.599486\nK Mn S\n4 6 8\ndirect\n0.508109 0.750000 0.250000 K\n0.491890 0.250000 0.750000 K\n0.000000 0.500000 -0.000000 K\n0.000000 -0.000000 0.500000 K\n0.249866 0.967791 0.968958 Mn\n0.249866 0.532208 0.531042 Mn\n0.750135 0.032208 0.031042 Mn\n0.750135 0.467792 0.468958 Mn\n0.249283 0.250000 0.250000 Mn\n0.750716 0.750000 0.750000 Mn\n0.533110 0.723252 0.937163 S\n0.533110 0.776748 0.562838 S\n0.031132 0.955764 0.169662 S\n0.031132 0.544236 0.330338 S\n0.466890 0.223252 0.437163 S\n0.968868 0.455764 0.669662 S\n0.968868 0.044236 0.830338 S\n0.466890 0.276748 0.062838 S\n",
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{
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"created_at": "2022-09-04T14:37:37.813863Z",
"updated_at": "2022-09-04T14:37:37.813888Z",
"structure_string": "U6 Nb2 Sb10\n1.0\n4.598393 -7.964650 0.000000\n4.598393 7.964650 -0.000000\n-0.000000 0.000000 6.112712\nU Nb Sb\n6 2 10\ndirect\n-0.000000 0.615229 0.250000 U\n-0.000000 0.384771 0.750000 U\n0.384771 -0.000000 0.750000 U\n0.384771 0.384771 0.250000 U\n0.615229 -0.000000 0.250000 U\n0.615229 0.615229 0.750000 U\n0.000000 0.000000 0.000000 Nb\n0.000000 0.000000 0.500000 Nb\n0.732722 0.732722 0.250000 Sb\n0.666667 0.333333 0.500000 Sb\n0.267277 -0.000000 0.250000 Sb\n-0.000000 0.732723 0.750000 Sb\n0.666667 0.333333 0.000000 Sb\n0.333333 0.666667 0.500000 Sb\n0.732723 -0.000000 0.750000 Sb\n0.333333 0.666667 0.000000 Sb\n0.267277 0.267277 0.750000 Sb\n-0.000000 0.267277 0.250000 Sb\n",
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{
"id": "jvasp-13040",
"created_at": "2022-09-04T14:38:03.693359Z",
"updated_at": "2022-09-04T14:38:03.693372Z",
"structure_string": "Na8 Sn2 S8\n1.0\n7.824596 0.000000 0.000000\n0.000000 7.824596 -0.000000\n-0.000000 0.000000 6.971859\nNa Sn S\n8 2 8\ndirect\n0.196782 0.409591 0.030826 Na\n0.590410 0.196782 0.969174 Na\n0.409591 0.803219 0.969174 Na\n0.803219 0.590410 0.030826 Na\n0.696782 0.090409 0.469174 Na\n0.303218 0.909591 0.469174 Na\n0.909591 0.696782 0.530826 Na\n0.090409 0.303218 0.530826 Na\n0.500000 0.500000 0.500000 Sn\n0.000000 0.000000 0.000000 Sn\n0.257941 0.595884 0.690693 S\n0.742059 0.404116 0.690693 S\n0.095884 0.757941 0.190693 S\n0.242059 0.095884 0.809307 S\n0.757941 0.904116 0.809307 S\n0.904116 0.242059 0.190693 S\n0.595884 0.742059 0.309307 S\n0.404116 0.257941 0.309307 S\n",
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{
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"created_at": "2022-09-04T14:37:37.677961Z",
"updated_at": "2022-09-04T14:37:37.677988Z",
"structure_string": "K4 Hf2 F12\n1.0\n6.568142 -0.000000 0.083024\n3.284071 5.700786 0.041513\n0.019704 -0.000000 6.884717\nK Hf F\n4 2 12\ndirect\n0.674636 0.688053 0.998636 K\n0.637310 0.688053 0.501364 K\n0.362688 0.311948 0.498636 K\n0.325363 0.311948 0.001364 K\n0.950795 0.098407 0.750000 Hf\n0.049203 0.901594 0.250000 Hf\n0.385913 0.609386 0.226082 F\n0.004700 0.609386 0.273918 F\n0.721979 0.974712 0.723411 F\n0.930491 0.198849 0.046129 F\n0.696690 0.025289 0.223411 F\n0.995299 0.390614 0.726082 F\n0.614085 0.390614 0.773917 F\n0.129340 0.801151 0.546129 F\n0.069508 0.801151 0.953871 F\n0.870659 0.198849 0.453870 F\n0.278020 0.025289 0.276588 F\n0.303309 0.974712 0.776588 F\n",
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{
"id": "jvasp-48055",
"created_at": "2022-09-04T14:37:58.103494Z",
"updated_at": "2022-09-04T14:37:58.103526Z",
"structure_string": "Li8 Co2 O8\n1.0\n6.194070 0.000000 0.000000\n-0.000000 6.194070 0.000000\n0.000000 0.000000 4.707095\nLi Co O\n8 2 8\ndirect\n0.199002 0.800998 0.000000 Li\n0.500000 0.000000 0.440515 Li\n0.500000 0.000000 0.940515 Li\n0.800998 0.199002 0.000000 Li\n0.300998 0.300998 0.499999 Li\n0.000000 0.500000 0.559484 Li\n0.000000 0.500000 0.059484 Li\n0.699002 0.699002 0.499999 Li\n0.500000 0.500000 0.000000 Co\n0.000000 0.000000 0.499999 Co\n0.485628 0.752072 0.200989 O\n0.747928 0.985628 0.700988 O\n0.252072 0.014372 0.700988 O\n0.514372 0.247928 0.200989 O\n0.014372 0.252072 0.299011 O\n0.247928 0.514372 0.799010 O\n0.752072 0.485628 0.799010 O\n0.985628 0.747928 0.299011 O\n",
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"volume": 180.59477521498496,
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{
"id": "jvasp-10106",
"created_at": "2022-09-04T14:37:58.723226Z",
"updated_at": "2022-09-04T14:37:58.723251Z",
"structure_string": "K8 Sn2 O8\n1.0\n6.527295 0.003500 0.006656\n2.522526 6.013369 0.043233\n3.092260 0.575052 9.275091\nK Sn O\n8 2 8\ndirect\n0.590709 0.242184 0.170535 K\n0.409293 0.757816 0.829465 K\n0.513241 0.774421 0.439142 K\n0.486761 0.225578 0.560858 K\n0.239851 0.258979 0.974612 K\n0.760150 0.741021 0.025388 K\n0.962326 0.720597 0.616347 K\n0.037675 0.279402 0.383653 K\n0.154558 0.780225 0.246712 Sn\n0.845443 0.219775 0.753288 Sn\n0.701357 0.469558 0.621343 O\n0.298644 0.530442 0.378657 O\n0.160161 0.031804 0.643102 O\n0.839840 0.968196 0.356898 O\n0.650575 0.028775 0.807430 O\n0.349426 0.971225 0.192570 O\n0.842898 0.365702 0.915568 O\n0.157104 0.634298 0.084432 O\n",
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{
"id": "jvasp-21594",
"created_at": "2022-09-04T14:37:59.680228Z",
"updated_at": "2022-09-04T14:37:59.680257Z",
"structure_string": "Ba2 Nd2 Cu2 B2 O10\n1.0\n5.547599 -0.000000 0.000000\n-0.000000 5.547599 -0.000000\n-0.000000 -0.000000 7.577454\nBa Nd Cu B O\n2 2 2 2 10\ndirect\n0.500000 0.500000 0.510070 Ba\n0.000000 0.000000 0.510070 Ba\n0.500000 0.500000 0.003490 Nd\n0.000000 0.000000 0.003490 Nd\n0.000000 0.500000 0.780683 Cu\n0.500000 0.000000 0.780683 Cu\n0.500000 0.000000 0.266151 B\n0.000000 0.500000 0.266151 B\n0.247650 0.252350 0.797348 O\n0.252350 0.752350 0.797348 O\n0.655437 0.844563 0.178273 O\n0.844563 0.344563 0.178273 O\n0.344563 0.155437 0.178273 O\n0.000000 0.500000 0.449761 O\n0.155437 0.655437 0.178273 O\n0.752350 0.747650 0.797348 O\n0.500000 0.000000 0.449761 O\n0.747650 0.247650 0.797348 O\n",
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{
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"created_at": "2022-09-04T14:38:04.043909Z",
"updated_at": "2022-09-04T14:38:04.043935Z",
"structure_string": "Mn6 O7 F5\n1.0\n5.451673 -0.006117 -0.012117\n1.728850 5.223780 0.008185\n2.216549 1.444843 6.744269\nMn O F\n6 7 5\ndirect\n0.688884 0.689236 0.838920 Mn\n0.338208 0.338175 0.672548 Mn\n0.678260 0.611370 0.308789 Mn\n0.329039 0.332073 0.164221 Mn\n0.986673 0.985862 0.504309 Mn\n0.977075 0.044530 0.002084 Mn\n0.686174 0.340569 0.000756 O\n0.642817 0.031579 0.671313 O\n0.970750 0.324992 0.328944 O\n0.770984 0.793489 0.029823 O\n0.228688 0.248497 0.957997 O\n0.028936 0.643503 0.673300 O\n0.429338 0.414793 0.378838 O\n0.110025 0.108704 0.685158 F\n0.365222 0.924568 0.341092 F\n0.893298 0.854052 0.312109 F\n0.575382 0.573490 0.640486 F\n0.300247 0.740508 0.989300 F\n",
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{
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"created_at": "2022-09-04T14:37:38.293151Z",
"updated_at": "2022-09-04T14:37:38.293177Z",
"structure_string": "Na1 Ga1 H8 N2 F6\n1.0\n-0.000000 -4.267926 4.267926\n-4.267926 4.267926 -0.000000\n-0.000000 -4.267926 -4.267926\nNa Ga H N F\n1 1 8 2 6\ndirect\n0.500000 0.000000 0.500000 Na\n0.000000 0.000000 0.000000 Ga\n0.459242 0.639496 0.819748 H\n0.180253 0.360505 0.819748 H\n0.180253 0.360505 0.540758 H\n0.180253 0.639496 0.819748 H\n0.819748 0.639496 0.180253 H\n0.819748 0.360505 0.180253 H\n0.540758 0.360505 0.180253 H\n0.819748 0.639496 0.459242 H\n0.750001 0.500000 0.250000 N\n0.250000 0.500000 0.750001 N\n0.774569 0.549138 0.774569 F\n0.225431 0.000000 0.225431 F\n0.225431 0.450863 0.225431 F\n0.774569 0.000000 0.225431 F\n0.225431 0.000000 0.774569 F\n0.774570 0.000000 0.774570 F\n",
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{
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"created_at": "2022-09-04T14:37:57.720286Z",
"updated_at": "2022-09-04T14:37:57.720306Z",
"structure_string": "Zn4 In4 S10\n1.0\n3.906477 -0.000000 0.000000\n-1.953238 3.383108 -0.000000\n-0.000000 -0.000000 30.693903\nZn In S\n4 4 10\ndirect\n0.333333 0.666667 0.309712 Zn\n0.666667 0.333333 0.809712 Zn\n0.666667 0.333333 0.063902 Zn\n0.333333 0.666667 0.563902 Zn\n0.333333 0.666667 0.920295 In\n0.000000 0.000000 0.187491 In\n0.000000 0.000000 0.687491 In\n0.666667 0.333333 0.420295 In\n0.333333 0.666667 0.644858 S\n0.333333 0.666667 0.838139 S\n0.666667 0.333333 0.954387 S\n0.666667 0.333333 0.144858 S\n0.666667 0.333333 0.338139 S\n0.333333 0.666667 0.454387 S\n0.333333 0.666667 0.042914 S\n0.666667 0.333333 0.736299 S\n0.333333 0.666667 0.236299 S\n0.666667 0.333333 0.542914 S\n",
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{
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"created_at": "2022-09-04T14:37:56.414177Z",
"updated_at": "2022-09-04T14:37:56.414209Z",
"structure_string": "Na4 Zn6 Se8\n1.0\n2.879108 -5.537092 -0.000000\n5.923907 -0.436827 6.770859\n-3.044802 -5.100263 6.770859\nNa Zn Se\n4 6 8\ndirect\n0.741121 0.623369 0.376631 Na\n0.258879 0.376632 0.623368 Na\n0.758879 0.123369 0.876631 Na\n0.241121 0.876632 0.123368 Na\n0.750000 0.461272 0.038728 Zn\n0.250000 0.538729 0.961271 Zn\n0.750000 0.038729 0.461271 Zn\n0.250000 0.250000 0.250000 Zn\n0.750000 0.750001 0.750000 Zn\n0.250000 0.961272 0.538728 Zn\n0.094599 0.766326 0.506116 Se\n0.594598 0.006116 0.266325 Se\n0.132960 0.266325 0.006116 Se\n0.905402 0.233675 0.493883 Se\n0.367040 0.493884 0.233675 Se\n0.405402 0.993884 0.733675 Se\n0.867040 0.733676 0.993883 Se\n0.632960 0.506117 0.766325 Se\n",
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]
}