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{
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{
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{
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"structure_string": "Ca1 Ti4 S8\n1.0\n7.095235 0.078063 0.055199\n3.615222 6.261746 0.000000\n3.615222 2.087249 5.903632\nCa Ti S\n1 4 8\ndirect\n0.500000 -0.000000 0.000000 Ca\n-0.000000 0.500000 0.500000 Ti\n0.499999 0.500000 0.000000 Ti\n0.499999 0.500000 0.500000 Ti\n0.500000 -0.000000 0.500000 Ti\n0.247754 0.261592 0.261591 S\n0.247754 0.261592 0.729064 S\n0.247753 0.729064 0.261592 S\n0.732334 0.255888 0.255888 S\n0.267665 0.744113 0.744112 S\n0.752245 0.738409 0.270936 S\n0.752245 0.270936 0.738408 S\n0.752245 0.738409 0.738408 S\n",
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{
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"structure_string": "Ca1 Ti8 S16\n1.0\n3.422212 -5.927445 -0.000000\n3.422212 5.927445 -0.000000\n0.000000 -0.000000 12.519527\nCa Ti S\n1 8 16\ndirect\n0.000000 0.000000 0.500000 Ca\n0.502168 0.004335 0.772145 Ti\n0.497832 0.995665 0.227855 Ti\n0.502167 0.497832 0.772145 Ti\n0.497832 0.502167 0.227855 Ti\n0.995665 0.497832 0.772145 Ti\n0.004335 0.502168 0.227855 Ti\n0.000000 0.000000 0.777541 Ti\n0.000000 0.000000 0.222460 Ti\n0.167315 0.334630 0.114364 S\n0.167261 0.334521 0.656437 S\n0.666667 0.333333 0.118003 S\n0.666667 0.333333 0.655358 S\n0.665369 0.832685 0.114364 S\n0.665478 0.832739 0.656437 S\n0.334630 0.167315 0.885636 S\n0.832685 0.665369 0.885636 S\n0.333333 0.666667 0.881998 S\n0.333333 0.666667 0.344642 S\n0.167261 0.832739 0.656437 S\n0.832739 0.665478 0.343563 S\n0.832685 0.167315 0.885636 S\n0.832739 0.167261 0.343563 S\n0.334521 0.167261 0.343563 S\n0.167315 0.832685 0.114364 S\n",
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{
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"structure_string": "Ca1 Ti1 S3\n1.0\n4.729345 0.000000 -0.000000\n0.000000 4.729345 -0.000000\n0.000000 0.000000 4.729345\nCa Ti S\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Ca\n0.500000 0.500000 0.500000 Ti\n0.500000 0.000000 0.500000 S\n0.500000 0.500000 0.000000 S\n0.000000 0.500000 0.500000 S\n",
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{
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"created_at": "2022-09-04T14:37:00.408804Z",
"updated_at": "2022-09-04T14:37:00.408838Z",
"structure_string": "Ca2 Ti2 Si4 O12\n1.0\n5.029304 -0.071578 0.959845\n1.073100 6.645075 0.771951\n-0.163521 0.195257 6.770496\nCa Ti Si O\n2 2 4 12\ndirect\n0.750000 0.301366 0.698635 Ca\n0.250001 0.698633 0.301368 Ca\n0.249999 0.070716 0.929286 Ti\n0.749999 0.929285 0.070715 Ti\n0.272637 0.195233 0.392709 Si\n0.227362 0.607292 0.804768 Si\n0.772637 0.392708 0.195234 Si\n0.727363 0.804767 0.607293 Si\n0.653179 0.966071 0.771148 O\n0.846821 0.228852 0.033929 O\n0.672249 0.623070 0.117513 O\n0.827749 0.882488 0.376930 O\n0.327750 0.376928 0.882488 O\n0.972274 0.618776 0.673956 O\n0.027725 0.381223 0.326046 O\n0.472275 0.673954 0.618779 O\n0.346820 0.033929 0.228853 O\n0.527725 0.326046 0.381223 O\n0.172250 0.117511 0.623072 O\n0.153180 0.771148 0.966072 O\n",
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{
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"created_at": "2022-09-04T14:37:30.312115Z",
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{
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{
"id": "jvasp-15087",
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"updated_at": "2022-09-04T14:35:52.585856Z",
"structure_string": "Ca1 Tl1\n1.0\n3.850150 0.000000 0.000000\n0.000000 3.850150 0.000000\n-0.000000 -0.000000 3.850150\nCa Tl\n1 1\ndirect\n0.000000 0.000000 0.000000 Ca\n0.500000 0.500000 0.500000 Tl\n",
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{
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}