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{
"id": "jvasp-48217",
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"structure_string": "Li3 Fe2 O6\n1.0\n4.889665 -0.004816 0.002812\n-2.431027 4.242491 0.000433\n-0.844005 -1.452056 4.632800\nLi Fe O\n3 2 6\ndirect\n0.999382 0.495198 0.000558 Li\n0.650689 0.844373 0.001068 Li\n0.348545 0.146506 0.001071 Li\n0.832238 0.663256 0.500896 Fe\n0.167428 0.328063 0.500897 Fe\n0.791370 0.287192 0.270817 O\n0.208276 0.704098 0.731013 O\n0.422647 0.548054 0.274288 O\n0.947451 0.072864 0.727505 O\n0.577041 0.443273 0.727501 O\n0.052230 0.918461 0.274278 O\n",
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{
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"updated_at": "2022-09-04T14:37:18.958928Z",
"structure_string": "Li4 Ti6 O12\n1.0\n7.791292 -1.776316 -3.673533\n1.949210 4.911603 -0.105585\n1.949210 -3.132808 3.784244\nLi Ti O\n4 6 12\ndirect\n0.007680 0.290363 0.717580 Li\n0.507679 0.967580 0.040363 Li\n0.325655 0.615747 0.042975 Li\n0.825655 0.292975 0.365748 Li\n0.166668 0.177978 0.155348 Ti\n0.995821 0.735953 0.267527 Ti\n0.337511 0.065805 0.597383 Ti\n0.495821 0.517526 0.485954 Ti\n0.666668 0.405347 0.927978 Ti\n0.837511 0.847381 0.815805 Ti\n0.838563 0.078881 0.599844 O\n0.494769 0.733484 0.254453 O\n0.338564 0.849842 0.828881 O\n0.666666 0.184705 0.148628 O\n0.494536 0.282087 0.736785 O\n0.994769 0.504452 0.483485 O\n0.338797 0.301242 0.346548 O\n0.166667 0.398627 0.934705 O\n0.994536 -0.013215 0.032088 O\n0.666667 0.643036 0.690297 O\n0.166667 0.940296 0.393037 O\n0.838797 0.596548 0.051243 O\n",
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{
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"updated_at": "2022-09-04T14:38:10.674551Z",
"structure_string": "Li4 Mn6 O12\n1.0\n4.894418 0.025044 -0.000000\n2.456448 4.269128 -0.000000\n0.000000 0.000000 9.992312\nLi Mn O\n4 6 12\ndirect\n0.500000 0.157971 0.750000 Li\n0.500001 0.342028 0.250000 Li\n0.500001 0.657972 0.750000 Li\n0.500001 0.842028 0.250000 Li\n0.000000 0.000000 0.000000 Mn\n0.000000 0.500000 0.500000 Mn\n0.324937 0.337531 0.000000 Mn\n0.324937 0.837531 0.500000 Mn\n0.675064 0.162469 0.500000 Mn\n0.675065 0.662469 0.000000 Mn\n0.661408 0.335138 0.893079 O\n0.661408 0.003453 0.106921 O\n0.338593 0.664861 0.106921 O\n0.338593 0.496546 0.606921 O\n0.338593 0.164861 0.393080 O\n0.000000 0.168526 0.603493 O\n0.338593 -0.003454 0.893079 O\n0.000000 0.668526 0.896507 O\n0.000000 0.331474 0.103492 O\n0.661408 0.503453 0.393080 O\n0.000000 0.831474 0.396507 O\n0.661408 0.835138 0.606921 O\n",
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{
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"created_at": "2022-09-04T14:38:11.982112Z",
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"structure_string": "Ni6 B4 O12\n1.0\n4.462586 -0.000000 0.000000\n0.000000 5.446544 0.000000\n0.000000 0.000000 8.319517\nNi B O\n6 4 12\ndirect\n0.000000 0.500000 0.815247 Ni\n0.500000 0.000000 0.684754 Ni\n0.000000 0.500000 0.184754 Ni\n0.500000 0.000000 0.315247 Ni\n0.500000 0.500000 0.500000 Ni\n0.000000 0.000000 0.000000 Ni\n0.040560 0.245691 0.500000 B\n0.459440 0.745690 0.000000 B\n0.959441 0.754309 0.500000 B\n0.540561 0.254309 0.000000 B\n0.756013 0.675092 0.000000 O\n0.256012 0.824907 0.500000 O\n0.743988 0.175093 0.500000 O\n0.243988 0.324907 0.000000 O\n0.200599 0.298086 0.640764 O\n0.299402 0.798085 0.140764 O\n0.700599 0.201914 0.859236 O\n0.299402 0.798085 0.859236 O\n0.799402 0.701914 0.359236 O\n0.700599 0.201914 0.140764 O\n0.799402 0.701914 0.640764 O\n0.200599 0.298086 0.359236 O\n",
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{
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"created_at": "2022-09-04T14:37:30.552173Z",
"updated_at": "2022-09-04T14:37:30.552193Z",
"structure_string": "Li3 V2 O6\n1.0\n4.908466 0.073670 -0.107243\n-2.341290 4.389165 0.001367\n-1.088663 -1.648741 4.786802\nLi V O\n3 2 6\ndirect\n0.004303 0.500335 -0.000283 Li\n0.680384 0.884971 -0.038534 Li\n0.328272 0.115735 0.038093 Li\n0.832508 0.676867 0.455332 V\n0.176173 0.323898 0.544161 V\n0.801745 0.297657 0.258717 O\n0.206953 0.703099 0.740774 O\n0.960023 0.085073 0.738695 O\n0.426469 0.555300 0.275624 O\n0.582243 0.445497 0.723822 O\n0.048691 0.915706 0.260808 O\n",
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{
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"created_at": "2022-09-04T14:38:02.456228Z",
"updated_at": "2022-09-04T14:38:02.456260Z",
"structure_string": "B4 C6 N12\n1.0\n-7.188537 4.764770 -0.037826\n-0.532143 8.607839 -0.037826\n-2.596830 4.497842 -4.787269\nB C N\n4 6 12\ndirect\n0.419689 0.346522 0.820037 B\n0.153507 0.080309 0.679912 B\n0.580309 0.653507 0.179912 B\n0.846522 0.919689 0.320037 B\n0.791563 0.708463 0.249964 C\n0.208464 0.291563 0.749963 C\n0.811472 0.163384 0.689504 C\n0.336638 0.688535 0.810450 C\n0.663384 0.311472 0.189504 C\n0.188535 0.836638 0.310450 C\n0.750360 0.644447 0.181847 N\n0.371665 0.807474 0.248127 N\n0.855608 0.749637 0.318082 N\n0.001384 0.882494 0.376638 N\n0.617511 0.498616 0.123355 N\n0.998616 0.117511 0.623355 N\n0.249637 0.355608 0.818081 N\n0.628345 0.192567 0.751793 N\n0.692568 0.128344 0.251793 N\n0.307474 0.871665 0.748127 N\n0.144447 0.250360 0.681847 N\n0.382494 0.501384 0.876639 N\n",
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{
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"created_at": "2022-09-04T14:38:02.838421Z",
"updated_at": "2022-09-04T14:38:02.838442Z",
"structure_string": "Mn6 O4 F12\n1.0\n0.000000 5.388142 -0.012666\n4.674014 0.000000 0.000000\n0.000000 -0.912617 -9.932786\nMn O F\n6 4 12\ndirect\n0.500000 0.500000 0.000000 Mn\n0.261863 0.973312 0.756609 Mn\n0.738136 0.473312 0.743392 Mn\n0.500000 0.000000 0.500000 Mn\n0.261863 0.526687 0.256609 Mn\n0.738136 0.026687 0.243392 Mn\n0.477705 0.674783 0.823364 O\n0.522294 0.174784 0.676637 O\n0.477706 0.825215 0.323364 O\n0.522294 0.325216 0.176637 O\n0.021446 0.232731 0.190839 F\n0.978554 0.732730 0.309161 F\n0.778971 0.182979 0.425108 F\n0.302370 0.325104 0.420978 F\n0.697629 0.674895 0.579022 F\n0.302370 0.174896 0.920979 F\n0.021446 0.267269 0.690840 F\n0.978553 0.767268 0.809161 F\n0.778971 0.317020 0.925108 F\n0.221028 0.682979 0.074893 F\n0.221028 0.817020 0.574893 F\n0.697629 0.825103 0.079022 F\n",
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{
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"updated_at": "2022-09-04T14:37:37.058332Z",
"structure_string": "Tb6 Mn4 C12\n1.0\n4.049667 -7.014229 0.000000\n4.049667 7.014229 -0.000000\n0.000000 0.000000 4.991176\nTb Mn C\n6 4 12\ndirect\n0.619569 0.684537 0.750001 Tb\n0.935033 0.619569 0.250000 Tb\n0.684537 0.064968 0.250000 Tb\n0.315464 0.935033 0.750001 Tb\n0.064968 0.380431 0.750001 Tb\n0.380432 0.315464 0.250000 Tb\n0.000000 0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.666667 0.333333 0.750001 Mn\n0.333333 0.666667 0.250000 Mn\n0.421281 0.286236 0.750001 C\n0.578720 0.713764 0.250000 C\n0.286237 0.864956 0.250000 C\n0.864956 0.578720 0.750001 C\n0.035828 0.227501 0.250000 C\n0.964173 0.772500 0.750001 C\n0.227501 0.191674 0.750001 C\n0.772500 0.808327 0.250000 C\n0.191674 0.964173 0.250000 C\n0.135045 0.421281 0.250000 C\n0.808326 0.035828 0.750001 C\n0.713764 0.135045 0.750001 C\n",
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"created_at": "2022-09-04T14:37:53.370835Z",
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"structure_string": "Ca6 Co4 O12\n1.0\n6.245443 0.036080 -0.243791\n-0.254895 6.240344 -0.243791\n0.034436 0.036080 6.250104\nCa Co O\n6 4 12\ndirect\n0.750000 0.379512 0.120488 Ca\n0.120489 0.750000 0.379512 Ca\n0.379513 0.120488 0.750000 Ca\n0.879512 0.250000 0.620488 Ca\n0.250001 0.620488 0.879512 Ca\n0.620488 0.879512 0.250000 Ca\n0.750001 0.750000 0.750000 Co\n0.500000 0.500000 0.500000 Co\n0.000000 0.000000 0.000000 Co\n0.250000 0.250000 0.250000 Co\n0.085873 0.291974 0.969231 O\n0.791974 0.585872 0.469232 O\n0.530768 0.208026 0.414128 O\n0.414129 0.530768 0.208026 O\n0.208027 0.414128 0.530768 O\n0.708027 0.030768 0.914128 O\n0.914128 0.708026 0.030768 O\n0.030769 0.914128 0.708026 O\n0.469233 0.791973 0.585872 O\n0.585872 0.469232 0.791973 O\n0.969232 0.085872 0.291974 O\n0.291974 0.969231 0.085872 O\n",
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}