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"id": "jvasp-105583",
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"structure_string": "Ti1 O2\n1.0\n2.748918 -0.072228 3.908126\n1.183962 2.481935 3.908126\n-0.117884 -0.072228 4.776620\nTi O\n1 2\ndirect\n0.000000 0.000000 0.000000 Ti\n0.261319 0.261317 0.261319 O\n0.738684 0.738680 0.738683 O\n",
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{
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{
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{
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"updated_at": "2022-09-04T14:38:52.338751Z",
"structure_string": "Cr3 Co1 P4 O16\n1.0\n5.640612 -0.000000 0.000000\n0.000000 4.698160 0.036831\n-0.000000 -0.000132 9.726031\nCr Co P O\n3 1 4 16\ndirect\n-0.000000 0.446785 0.770181 Cr\n0.500000 0.556491 0.230539 Cr\n0.500000 0.946045 0.732352 Cr\n-0.000000 0.058034 0.268833 Co\n0.500000 0.123114 0.411992 P\n0.500000 0.382103 0.915269 P\n-0.000000 0.608489 0.085617 P\n-0.000000 0.887297 0.587272 P\n0.787813 0.731537 0.666894 O\n0.500000 0.804531 0.385479 O\n0.500000 0.701981 0.891337 O\n0.216289 0.754118 0.161892 O\n0.783711 0.754118 0.161892 O\n-0.000000 0.684568 0.932677 O\n0.500000 0.312388 0.067990 O\n-0.000000 0.206107 0.612060 O\n0.288442 0.228929 0.836099 O\n-0.000000 0.287581 0.105427 O\n0.212187 0.731537 0.666894 O\n0.710022 0.282622 0.335765 O\n0.289978 0.282622 0.335765 O\n0.500000 0.178713 0.566031 O\n0.711557 0.228929 0.836099 O\n-0.000000 0.821366 0.435645 O\n",
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{
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"created_at": "2022-09-04T14:36:20.009551Z",
"updated_at": "2022-09-04T14:36:20.009570Z",
"structure_string": "K6 Sm2 P4 O16\n1.0\n5.645358 0.000000 0.000000\n0.000000 7.392253 -0.103147\n0.000000 0.013352 9.502261\nK Sm P O\n6 2 4 16\ndirect\n0.250000 0.800324 0.917787 K\n0.750000 0.199676 0.082213 K\n0.750000 0.634596 0.408255 K\n0.250000 0.365403 0.591745 K\n0.750000 0.493047 0.808845 K\n0.250000 0.506953 0.191155 K\n0.750000 0.993148 0.708625 Sm\n0.250000 0.006851 0.291375 Sm\n0.250000 0.806048 0.574258 P\n0.250000 0.234785 0.912597 P\n0.750000 0.765214 0.087403 P\n0.750000 0.193951 0.425741 P\n0.025872 0.154781 0.838394 O\n0.250000 0.441430 0.898974 O\n0.750000 0.558569 0.101025 O\n0.474925 0.749277 0.657392 O\n0.974925 0.250723 0.342608 O\n0.525075 0.250723 0.342608 O\n0.025075 0.749277 0.657392 O\n0.250000 0.013305 0.550471 O\n0.750000 0.986695 0.449528 O\n0.250000 0.715112 0.425163 O\n0.750000 0.284887 0.574837 O\n0.525872 0.845218 0.161605 O\n0.974128 0.845218 0.161605 O\n0.474128 0.154781 0.838394 O\n0.250000 0.176196 0.069487 O\n0.750000 0.823803 0.930513 O\n",
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"created_at": "2022-09-04T14:37:31.134812Z",
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"structure_string": "Ba1 Na2 Mg1 P2 O8\n1.0\n2.663495 -4.613308 -0.000000\n2.663495 4.613308 -0.000000\n-0.000000 0.000000 7.009164\nBa Na Mg P O\n1 2 1 2 8\ndirect\n0.000000 0.000000 0.500000 Ba\n0.333332 0.666666 0.819014 Na\n0.666666 0.333332 0.180986 Na\n0.000000 0.000000 0.000000 Mg\n0.666666 0.333332 0.744202 P\n0.333332 0.666666 0.255798 P\n0.874764 0.231385 0.822295 O\n0.356620 0.125234 0.822295 O\n0.768612 0.643378 0.822295 O\n0.666666 0.333332 0.524884 O\n0.333332 0.666666 0.475116 O\n0.231386 0.356620 0.177704 O\n0.643378 0.874764 0.177704 O\n0.125234 0.768613 0.177704 O\n",
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{
"id": "jvasp-117805",
"created_at": "2022-09-04T14:38:53.770449Z",
"updated_at": "2022-09-04T14:38:53.770483Z",
"structure_string": "In1 Br1 O1\n1.0\n6.235585 0.152923 0.000000\n0.123180 3.561230 0.000000\n0.000000 0.000000 4.114928\nIn Br O\n1 1 1\ndirect\n-0.131268 -0.140714 0.000000 In\n0.475407 0.028365 0.000000 Br\n0.019768 0.348042 0.000000 O\n",
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{
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"created_at": "2022-09-04T14:37:37.547673Z",
"updated_at": "2022-09-04T14:37:37.547709Z",
"structure_string": "V1 Cu1 O3\n1.0\n-3.187718 0.027880 -0.055206\n-0.038687 -4.461988 -0.162796\n1.512911 1.961923 5.046861\nV Cu O\n1 1 3\ndirect\n0.725772 0.337277 0.103247 V\n0.403862 0.006974 0.461954 Cu\n0.854912 0.208290 0.362872 O\n0.581543 0.003727 0.812545 O\n0.242512 0.558032 0.137279 O\n",
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{
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"created_at": "2022-09-04T14:38:49.944826Z",
"updated_at": "2022-09-04T14:38:49.944853Z",
"structure_string": "Al4 Fe2 N6\n1.0\n5.496204 0.002916 0.000000\n-2.749039 4.757478 0.000000\n-0.000000 -0.000000 5.029572\nAl Fe N\n4 2 6\ndirect\n0.335679 0.331469 0.492186 Al\n0.664320 0.995790 0.492186 Al\n0.664320 0.668532 0.992186 Al\n0.335679 0.004211 0.992186 Al\n0.000000 0.667242 0.483959 Fe\n0.000000 0.332759 0.983959 Fe\n0.346224 0.335480 0.870016 N\n0.653776 0.989256 0.870016 N\n0.653776 0.664522 0.370017 N\n0.346224 0.010745 0.370017 N\n0.000000 0.683650 0.879633 N\n0.000000 0.316350 0.379634 N\n",
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"updated_at": "2022-09-04T14:37:55.980975Z",
"structure_string": "Li2 Fe4 O3 F8\n1.0\n4.977268 -0.003372 -0.013007\n-0.764735 6.390240 -0.104134\n-1.835603 -2.433246 6.001510\nLi Fe O F\n2 4 3 8\ndirect\n0.669928 0.195521 0.400586 Li\n0.330072 0.804478 0.599414 Li\n0.908267 0.248514 0.969670 Fe\n0.345489 0.374857 0.780071 Fe\n0.654511 0.625143 0.219929 Fe\n0.091734 0.751485 0.030330 Fe\n0.728997 0.530327 0.943602 O\n0.271003 0.469673 0.056398 O\n0.000000 0.000000 0.000000 O\n0.050459 0.796701 0.344116 F\n0.473961 0.113800 0.809014 F\n0.949541 0.203299 0.655884 F\n0.379277 0.285961 0.500509 F\n0.789833 0.368382 0.250616 F\n0.210167 0.631617 0.749384 F\n0.620723 0.714038 0.499492 F\n0.526039 0.886200 0.190986 F\n",
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{
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"structure_string": "Ca1 Be1 Se2\n1.0\n-1.906058 1.906058 6.171306\n1.906058 -1.906058 6.171306\n1.906058 1.906058 -6.171306\nCa Be Se\n1 1 2\ndirect\n0.750001 0.250000 0.500000 Ca\n0.500000 0.500000 0.000000 Be\n0.000000 0.000000 0.000000 Se\n0.250000 0.750001 0.500000 Se\n",
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"structure_string": "Mg1 Al2 Se4\n1.0\n3.870549 0.005110 12.534571\n1.895479 3.374661 12.534571\n0.008718 0.005110 13.118557\nMg Al Se\n1 2 4\ndirect\n0.167572 0.167572 0.167572 Mg\n0.404381 0.404380 0.404380 Al\n0.930763 0.930761 0.930761 Al\n0.871271 0.871270 0.871269 Se\n0.463873 0.463872 0.463872 Se\n0.291577 0.291577 0.291577 Se\n0.043566 0.043566 0.043566 Se\n",
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}