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{
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"structure_string": "Sr12 Ga8 N16\n1.0\n5.977340 -0.000000 0.000000\n0.000000 9.528925 0.000000\n0.000000 0.000000 10.318592\nSr Ga N\n12 8 16\ndirect\n0.890417 0.087153 0.654749 Sr\n0.250000 0.596635 0.500000 Sr\n0.250000 0.903364 0.000000 Sr\n0.750000 0.096635 0.000000 Sr\n0.390417 0.587153 0.845251 Sr\n0.750000 0.403365 0.500000 Sr\n0.109583 0.587153 0.154749 Sr\n0.109583 0.912846 0.345251 Sr\n0.609583 0.412847 0.154749 Sr\n0.609583 0.087153 0.345251 Sr\n0.390417 0.912846 0.654749 Sr\n0.890417 0.412847 0.845251 Sr\n0.158575 0.250000 0.250000 Ga\n0.250000 0.270615 0.500000 Ga\n0.750000 0.770615 0.000000 Ga\n0.750000 0.729384 0.500000 Ga\n0.250000 0.229384 0.000000 Ga\n0.341425 0.250000 0.750000 Ga\n0.658575 0.750000 0.250000 Ga\n0.841425 0.750000 0.750000 Ga\n0.875001 0.622639 0.352639 N\n0.495121 0.331948 0.905481 N\n0.004879 0.168052 0.405482 N\n0.004879 0.331948 0.094518 N\n0.504879 0.831948 0.405482 N\n0.504879 0.668051 0.094518 N\n0.995121 0.831948 0.594518 N\n0.995121 0.668051 0.905481 N\n0.124999 0.122639 0.852639 N\n0.375001 0.377361 0.352639 N\n0.375001 0.122639 0.147361 N\n0.875001 0.877360 0.147361 N\n0.624999 0.622639 0.647361 N\n0.624999 0.877360 0.852639 N\n0.124999 0.377361 0.647361 N\n0.495121 0.168052 0.594518 N\n",
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{
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{
"id": "jvasp-12791",
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"structure_string": "Sc8 Cu8 O20\n1.0\n3.231736 0.000000 0.000000\n0.000000 10.542983 0.000000\n0.000000 0.000000 12.103181\nSc Cu O\n8 8 20\ndirect\n0.718001 0.460503 0.669325 Sc\n0.781779 0.789357 0.999576 Sc\n0.218223 0.210643 0.499576 Sc\n0.718223 0.289357 0.999576 Sc\n0.281778 0.710643 0.499576 Sc\n0.782001 0.960503 0.669325 Sc\n0.218000 0.039497 0.169325 Sc\n0.282000 0.539496 0.169325 Sc\n0.851794 0.760358 0.278597 Cu\n0.344919 0.009661 0.890742 Cu\n0.655082 0.990339 0.390742 Cu\n0.155082 0.509661 0.890742 Cu\n0.844919 0.490339 0.390742 Cu\n0.351794 0.739641 0.778597 Cu\n0.648208 0.260359 0.278597 Cu\n0.148207 0.239641 0.778597 Cu\n0.784073 0.669024 0.135815 O\n0.215928 0.330976 0.635815 O\n0.272707 0.918835 0.033612 O\n0.287341 0.681923 0.934842 O\n0.727294 0.081164 0.533612 O\n0.227293 0.418835 0.033612 O\n0.772708 0.581164 0.533612 O\n0.717376 0.932464 0.234860 O\n0.282625 0.067536 0.734860 O\n0.782626 0.432464 0.234860 O\n0.284072 0.830975 0.635815 O\n0.217376 0.567536 0.734860 O\n0.790673 0.375257 0.834630 O\n0.290672 0.124743 0.334630 O\n0.709329 0.875257 0.834630 O\n0.787341 0.818076 0.434842 O\n0.212660 0.181923 0.934842 O\n0.712660 0.318077 0.434842 O\n0.209329 0.624743 0.334630 O\n0.715929 0.169024 0.135815 O\n",
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{
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"updated_at": "2022-09-04T14:37:11.852198Z",
"structure_string": "B4 S4 F28\n1.0\n5.534003 0.000000 0.000000\n0.000000 8.998796 0.000000\n0.000000 0.000000 9.201644\nB S F\n4 4 28\ndirect\n0.750000 0.162811 0.481021 B\n0.750000 0.337189 0.981021 B\n0.250000 0.662811 0.018979 B\n0.250000 0.837190 0.518979 B\n0.250000 0.392033 0.771123 S\n0.750000 0.607968 0.228877 S\n0.750000 0.892033 0.728877 S\n0.250000 0.107968 0.271123 S\n0.250000 0.234032 0.706225 F\n0.750000 0.159816 0.635286 F\n0.250000 0.840184 0.364714 F\n0.250000 0.659817 0.864714 F\n0.750000 0.340184 0.135286 F\n0.750000 0.482066 0.926521 F\n0.250000 0.982067 0.573478 F\n0.250000 0.517934 0.073478 F\n0.750000 0.765969 0.293775 F\n0.541106 0.239745 0.430680 F\n0.041106 0.760255 0.569320 F\n0.750000 0.017934 0.426522 F\n0.750000 0.734032 0.793775 F\n0.459469 0.046834 0.175151 F\n0.540530 0.546835 0.324848 F\n0.040531 0.453166 0.675151 F\n0.458893 0.739745 0.069320 F\n0.959469 0.953166 0.824848 F\n0.459469 0.453166 0.675151 F\n0.959469 0.546835 0.324848 F\n0.540530 0.953166 0.824848 F\n0.040531 0.046834 0.175151 F\n0.541106 0.260255 0.930680 F\n0.958893 0.239745 0.430680 F\n0.458893 0.760255 0.569320 F\n0.041106 0.739745 0.069320 F\n0.250000 0.265968 0.206225 F\n0.958893 0.260255 0.930680 F\n",
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{
"id": "jvasp-29760",
"created_at": "2022-09-04T14:37:10.335290Z",
"updated_at": "2022-09-04T14:37:10.335323Z",
"structure_string": "Mo12 Cl24\n1.0\n8.958493 0.074695 0.000000\n-1.894689 8.756159 -0.000000\n-0.000000 -0.000000 11.325229\nMo Cl\n12 24\ndirect\n0.633465 0.366534 0.500000 Mo\n0.435196 0.435196 0.350210 Mo\n0.133465 0.866535 0.000000 Mo\n0.849956 0.849956 0.935441 Mo\n0.064803 0.064803 0.850210 Mo\n0.564803 0.564803 0.649790 Mo\n0.366534 0.633465 0.500000 Mo\n0.935196 0.935196 0.149790 Mo\n0.150043 0.150044 0.064559 Mo\n0.650043 0.650043 0.435441 Mo\n0.349956 0.349956 0.564559 Mo\n0.866534 0.133465 0.000000 Mo\n0.831620 0.578138 0.581687 Cl\n0.142333 0.142333 0.642567 Cl\n0.804903 0.195096 0.500000 Cl\n0.921861 0.668379 0.081687 Cl\n0.304903 0.695097 0.000000 Cl\n0.791976 0.044327 0.795395 Cl\n0.544327 0.291976 0.704605 Cl\n0.578138 0.831621 0.581687 Cl\n0.668379 0.921861 0.081687 Cl\n0.421861 0.168379 0.418313 Cl\n0.708023 0.455673 0.295395 Cl\n0.331621 0.078138 0.918313 Cl\n0.195096 0.804903 0.500000 Cl\n0.642333 0.642333 0.857433 Cl\n0.695096 0.304903 0.000000 Cl\n0.044327 0.791976 0.795395 Cl\n0.291976 0.544327 0.704605 Cl\n0.955672 0.208023 0.204605 Cl\n0.357667 0.357667 0.142567 Cl\n0.078138 0.331621 0.918313 Cl\n0.168379 0.421862 0.418313 Cl\n0.208024 0.955673 0.204605 Cl\n0.857666 0.857666 0.357433 Cl\n0.455673 0.708024 0.295395 Cl\n",
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{
"id": "jvasp-26074",
"created_at": "2022-09-04T14:37:11.854150Z",
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"structure_string": "Rb12 Fe8 Se16\n1.0\n7.611369 0.000000 0.000000\n-0.000000 11.199298 0.000000\n0.000000 0.000000 12.552353\nRb Fe Se\n12 8 16\ndirect\n0.093521 0.250000 0.763467 Rb\n0.593521 0.250000 0.736533 Rb\n0.906479 0.750000 0.236533 Rb\n0.406479 0.750000 0.263467 Rb\n0.081915 0.435754 0.133891 Rb\n0.581915 0.064246 0.366109 Rb\n0.918085 0.935754 0.866108 Rb\n0.418085 0.564246 0.633891 Rb\n0.918085 0.564246 0.866108 Rb\n0.418085 0.935754 0.633891 Rb\n0.081915 0.064246 0.133891 Rb\n0.581915 0.435754 0.366109 Rb\n0.555621 0.366091 0.029439 Fe\n0.055621 0.133909 0.470561 Fe\n0.944380 0.633909 0.529439 Fe\n0.444379 0.866091 0.970560 Fe\n0.944380 0.866091 0.529439 Fe\n0.555621 0.133909 0.029439 Fe\n0.055621 0.366091 0.470561 Fe\n0.444379 0.633909 0.970560 Fe\n0.354750 0.055329 0.893961 Se\n0.854750 0.444672 0.606038 Se\n0.354750 0.444672 0.893961 Se\n0.854750 0.055329 0.606038 Se\n0.645250 0.944672 0.106039 Se\n0.145250 0.555329 0.393961 Se\n0.074780 0.750000 0.667897 Se\n0.925220 0.250000 0.332103 Se\n0.425220 0.250000 0.167897 Se\n0.191707 0.750000 0.030126 Se\n0.691707 0.750000 0.469874 Se\n0.808294 0.250000 0.969874 Se\n0.308293 0.250000 0.530126 Se\n0.145250 0.944672 0.393961 Se\n0.574780 0.750000 0.832102 Se\n0.645250 0.555329 0.106039 Se\n",
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"structure_string": "Nb6 Cl30\n1.0\n5.796941 -0.008266 0.041959\n0.088353 12.771453 0.333919\n-0.019922 -0.002561 12.776108\nNb Cl\n6 30\ndirect\n0.000000 0.111523 0.888477 Nb\n0.487356 0.221660 0.444818 Nb\n0.512644 0.555181 0.778340 Nb\n-0.000000 0.888476 0.111523 Nb\n0.487356 0.444818 0.221661 Nb\n0.512644 0.778339 0.555182 Nb\n0.265575 0.802924 0.417273 Cl\n0.734425 0.582726 0.197076 Cl\n0.285206 0.614029 0.614029 Cl\n0.240794 0.469458 0.083580 Cl\n0.724752 0.132493 0.327926 Cl\n0.275248 0.672074 0.867507 Cl\n0.275248 0.867507 0.672075 Cl\n0.724752 0.327925 0.132493 Cl\n0.240794 0.083580 0.469459 Cl\n0.759204 0.530541 0.916420 Cl\n0.759204 0.916419 0.530542 Cl\n0.714793 0.385971 0.385971 Cl\n0.249262 0.338218 0.534111 Cl\n0.230738 0.947325 0.947326 Cl\n0.750738 0.465889 0.661783 Cl\n0.750737 0.661782 0.465890 Cl\n0.249262 0.534110 0.338218 Cl\n0.734425 0.197075 0.582727 Cl\n0.265575 0.417273 0.802925 Cl\n0.751511 0.249810 0.863698 Cl\n0.259270 0.280679 0.280679 Cl\n0.248489 0.136302 0.750190 Cl\n0.751511 0.863697 0.249810 Cl\n0.232548 0.200701 0.005232 Cl\n0.767451 0.994767 0.799299 Cl\n0.767452 0.799298 0.994768 Cl\n0.232548 0.005232 0.200701 Cl\n0.769261 0.052674 0.052675 Cl\n0.248489 0.750189 0.136302 Cl\n0.740729 0.719320 0.719321 Cl\n",
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{
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{
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