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{
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{
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{
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{
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"structure_string": "Ba3 P6 N8 O6\n1.0\n3.724564 -6.451133 0.000000\n3.724564 6.451134 -0.000000\n0.000000 -0.000000 6.369293\nBa P N O\n3 6 8 6\ndirect\n0.333333 0.666666 0.614915 Ba\n0.666666 0.333333 0.385084 Ba\n0.000000 0.000000 0.500000 Ba\n0.224112 0.824128 0.102873 P\n0.600015 0.775887 0.102873 P\n0.175871 0.399984 0.102873 P\n0.775887 0.175871 0.897126 P\n0.399983 0.224112 0.897126 P\n0.824128 0.600015 0.897126 P\n0.977242 0.671988 0.098188 N\n0.328011 0.305253 0.098188 N\n0.694746 0.022757 0.098188 N\n0.022757 0.328011 0.901812 N\n0.305253 0.977242 0.901812 N\n0.666666 0.333333 0.927379 N\n0.333333 0.666666 0.072620 N\n0.671988 0.694746 0.901812 N\n0.368109 0.291974 0.678556 O\n0.291973 0.923864 0.321443 O\n0.631890 0.708025 0.321443 O\n0.076135 0.368110 0.321443 O\n0.708026 0.076135 0.678556 O\n0.923864 0.631889 0.678556 O\n",
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{
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"structure_string": "Ba6 P8 O26\n1.0\n7.374414 0.019055 -1.916945\n-2.612844 7.797392 -2.763352\n-0.019515 -0.069899 10.645928\nBa P O\n6 8 26\ndirect\n0.500000 -0.000000 -0.000000 Ba\n0.153668 0.233855 0.233464 Ba\n0.846331 0.766144 0.766536 Ba\n-0.000000 -0.000000 0.500000 Ba\n0.368749 0.780907 0.269000 Ba\n0.631250 0.219092 0.730999 Ba\n0.157424 0.179659 0.857185 P\n0.842575 0.820340 0.142815 P\n0.678185 0.210717 0.368589 P\n0.321814 0.789282 0.631411 P\n0.337848 0.454341 0.634776 P\n0.849624 0.480773 0.135346 P\n0.150375 0.519226 0.864654 P\n0.662151 0.545658 0.365223 P\n0.462703 0.482249 0.260187 O\n0.059739 0.501997 0.176859 O\n0.940260 0.498002 0.823141 O\n0.184183 0.452588 0.714303 O\n0.815816 0.547411 0.285697 O\n0.537296 0.517750 0.739813 O\n0.296362 0.159107 0.777249 O\n0.715509 0.305640 0.032001 O\n0.703636 0.840892 0.222750 O\n0.947060 0.102403 0.757897 O\n0.052939 0.897596 0.242102 O\n0.188178 0.115808 0.976210 O\n0.811821 0.884191 0.023790 O\n0.200397 0.388064 0.933213 O\n0.799602 0.611935 0.066787 O\n0.722527 0.722733 0.481231 O\n0.710534 0.151878 0.490503 O\n0.829382 0.208935 0.299400 O\n0.170617 0.791064 0.700600 O\n0.472139 0.119107 0.262421 O\n0.527860 0.880892 0.737579 O\n0.694631 0.418164 0.443267 O\n0.305368 0.581835 0.556732 O\n0.284490 0.694359 0.967999 O\n0.289465 0.848121 0.509497 O\n0.277471 0.277266 0.518769 O\n",
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{
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"created_at": "2022-09-04T14:36:53.482217Z",
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"structure_string": "Ba6 P8\n1.0\n5.894250 -0.000000 1.987806\n2.947125 7.485325 0.993903\n0.020207 -0.000000 9.672811\nBa P\n6 8\ndirect\n0.594657 0.990183 0.337507 Ba\n0.922346 0.009817 0.662493 Ba\n0.334840 0.509817 0.837507 Ba\n0.682163 0.490183 0.162493 Ba\n0.002009 0.500000 0.500000 Ba\n0.252008 0.000000 0.000000 Ba\n0.419035 0.658531 0.493715 P\n0.571280 0.341469 0.506285 P\n0.827566 0.841468 0.993715 P\n0.662749 0.158531 0.006285 P\n0.346259 0.190932 0.654589 P\n0.191780 0.809068 0.345410 P\n0.750850 0.690931 0.845411 P\n0.287191 0.309068 0.154589 P\n",
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{
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"created_at": "2022-09-04T14:37:29.943616Z",
"updated_at": "2022-09-04T14:37:29.943641Z",
"structure_string": "Ba3 P2\n1.0\n6.011464 -0.000000 0.000000\n-0.000000 6.011464 0.000000\n-0.000000 -0.000000 6.011464\nBa P\n3 2\ndirect\n0.000000 0.500000 0.500000 Ba\n0.500000 0.000000 0.500000 Ba\n0.500000 0.500000 0.000000 Ba\n0.000000 0.000000 0.000000 P\n0.500000 0.500000 0.500000 P\n",
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{
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"structure_string": "Ba6 Ni2 Sb4 O18\n1.0\n2.937946 -5.088672 0.000000\n2.937946 5.088672 -0.000000\n0.000000 0.000000 14.526091\nBa Ni Sb O\n6 2 4 18\ndirect\n0.333334 0.666668 0.587230 Ba\n0.666668 0.333334 0.087230 Ba\n0.666668 0.333334 0.412770 Ba\n0.333334 0.666668 0.912770 Ba\n0.000000 0.000000 0.750000 Ba\n0.000000 0.000000 0.250000 Ba\n0.000000 0.000000 0.000000 Ni\n0.000000 0.000000 0.500000 Ni\n0.333334 0.666668 0.349586 Sb\n0.666668 0.333334 0.849586 Sb\n0.333334 0.666668 0.150414 Sb\n0.666668 0.333334 0.650414 Sb\n0.032552 0.516276 0.250000 O\n0.967450 0.483725 0.750000 O\n0.516276 0.483725 0.750000 O\n0.483725 0.967450 0.250000 O\n0.165919 0.331838 0.418904 O\n0.834081 0.165920 0.918904 O\n0.331838 0.165919 0.918904 O\n0.668163 0.834082 0.418904 O\n0.668163 0.834082 0.081096 O\n0.834082 0.668163 0.581096 O\n0.834081 0.165920 0.581096 O\n0.834082 0.668163 0.918904 O\n0.331838 0.165919 0.581096 O\n0.483725 0.516276 0.250000 O\n0.165919 0.331838 0.081096 O\n0.165920 0.834081 0.081096 O\n0.165920 0.834081 0.418904 O\n0.516276 0.032552 0.750000 O\n",
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{
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{
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}