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{
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{
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{
"id": "mp-1220124",
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"structure_string": "P2 H18 C2 N8 O8\n1.0\n6.915974 0.000000 0.000000\n1.251984 7.009128 0.000000\n1.195381 0.178160 7.428765\nP H C N O\n2 18 2 8 8\ndirect\n0.296829 0.753178 0.992099 P\n0.701344 0.240841 0.009218 P\n0.918141 0.750262 0.816603 H\n0.081869 0.249701 0.183461 H\n0.939527 0.773429 0.269378 H\n0.060300 0.226955 0.730284 H\n0.451247 0.493344 0.844575 H\n0.554466 0.503725 0.154833 H\n0.224458 0.690288 0.623283 H\n0.775538 0.309280 0.376494 H\n0.604981 0.700273 0.352861 H\n0.395097 0.300010 0.647485 H\n0.993528 0.013830 0.998032 H\n0.697579 0.784993 0.720062 H\n0.302839 0.213203 0.278856 H\n0.605920 0.929811 0.359658 H\n0.394875 0.070068 0.638303 H\n0.229301 0.706920 0.387578 H\n0.771182 0.293359 0.612453 H\n0.494060 0.984116 0.987613 H\n0.953561 0.750702 0.540939 C\n0.046676 0.249523 0.458740 C\n0.651053 0.800909 0.420870 N\n0.348868 0.199763 0.579170 N\n0.859672 0.764688 0.396296 N\n0.140395 0.235578 0.603578 N\n0.848544 0.757406 0.706367 N\n0.151839 0.242940 0.293362 N\n0.151880 0.731108 0.515541 N\n0.848389 0.269163 0.484339 N\n0.421181 0.908168 0.902644 O\n0.589422 0.081762 0.090514 O\n0.371650 0.664976 0.162615 O\n0.633580 0.336558 0.837842 O\n0.072473 0.832608 0.020683 O\n0.933183 0.167623 0.976896 O\n0.324924 0.595618 0.842526 O\n0.679128 0.400622 0.156948 O\n",
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{
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"created_at": "2022-09-04T14:44:07.322866Z",
"structure_string": "Ba10 Ta10 N9 O21\n1.0\n4.131576 0.000000 0.000000\n0.000000 4.137899 0.000000\n0.000000 0.000000 41.513117\nBa Ta N O\n10 10 9 21\ndirect\n0.000000 0.000000 0.798465 Ba\n0.000000 0.000000 0.900285 Ba\n0.000000 0.000000 0.000000 Ba\n0.000000 0.000000 0.201535 Ba\n0.000000 0.000000 0.300318 Ba\n0.000000 0.000000 0.599930 Ba\n0.000000 0.000000 0.099715 Ba\n0.000000 0.000000 0.500000 Ba\n0.000000 0.000000 0.400070 Ba\n0.000000 0.000000 0.699682 Ba\n0.500000 0.500000 0.852586 Ta\n0.500000 0.500000 0.048807 Ta\n0.500000 0.500000 0.951193 Ta\n0.500000 0.500000 0.147414 Ta\n0.500000 0.500000 0.349948 Ta\n0.500000 0.500000 0.249665 Ta\n0.500000 0.500000 0.550004 Ta\n0.500000 0.500000 0.449996 Ta\n0.500000 0.500000 0.750335 Ta\n0.500000 0.500000 0.650052 Ta\n0.500000 0.500000 0.000000 N\n0.500000 0.500000 0.898888 N\n0.500000 0.500000 0.101112 N\n0.500000 0.000000 0.350012 N\n0.500000 0.000000 0.450015 N\n0.500000 0.000000 0.549985 N\n0.500000 0.000000 0.249782 N\n0.500000 0.000000 0.649988 N\n0.500000 0.000000 0.750218 N\n0.000000 0.500000 0.848855 O\n0.000000 0.500000 0.949793 O\n0.000000 0.500000 0.050207 O\n0.000000 0.500000 0.151145 O\n0.000000 0.500000 0.350028 O\n0.000000 0.500000 0.450016 O\n0.000000 0.500000 0.549984 O\n0.000000 0.500000 0.649972 O\n0.500000 0.000000 0.849365 O\n0.500000 0.500000 0.799464 O\n0.500000 0.000000 0.050172 O\n0.500000 0.500000 0.200536 O\n0.500000 0.000000 0.949828 O\n0.500000 0.500000 0.400042 O\n0.500000 0.500000 0.300124 O\n0.500000 0.000000 0.150635 O\n0.500000 0.500000 0.500000 O\n0.500000 0.500000 0.599958 O\n0.500000 0.500000 0.699876 O\n0.000000 0.500000 0.250085 O\n0.000000 0.500000 0.749915 O\n",
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{
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"structure_string": "Li4 P20\n1.0\n6.597135 0.000000 0.000000\n0.000000 6.686655 0.000000\n0.000000 0.000000 10.512149\nLi P\n4 20\ndirect\n0.055380 0.457128 0.921927 Li\n0.555380 0.542872 0.078073 Li\n0.055380 0.042872 0.421927 Li\n0.555380 0.957128 0.578073 Li\n0.425217 0.914651 0.915615 P\n0.925217 0.085349 0.084385 P\n0.425217 0.585349 0.415615 P\n0.925217 0.414651 0.584385 P\n0.909649 0.901077 0.907289 P\n0.409649 0.098923 0.092711 P\n0.909649 0.598923 0.407289 P\n0.409649 0.401077 0.592711 P\n0.167017 0.922793 0.192760 P\n0.667017 0.077207 0.807240 P\n0.167017 0.577207 0.692760 P\n0.667017 0.422793 0.307240 P\n0.166932 0.446067 0.308527 P\n0.666932 0.553933 0.691473 P\n0.166932 0.053933 0.808527 P\n0.666932 0.946067 0.191473 P\n0.184805 0.611442 0.129303 P\n0.684805 0.388558 0.870697 P\n0.184805 0.888558 0.629303 P\n0.684805 0.111442 0.370697 P\n",
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{
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"structure_string": "Ca8 Mn8 V12 Ag4 O48\n1.0\n-6.370663 6.370663 6.422836\n6.370663 -6.370663 6.422836\n6.370663 6.370663 -6.422836\nCa Mn V Ag O\n8 8 12 4 48\ndirect\n0.625000 0.253812 0.128812 Ca\n0.246188 0.875000 0.871188 Ca\n0.625000 0.753812 0.628812 Ca\n0.003812 0.375000 0.128812 Ca\n0.746188 0.875000 0.371188 Ca\n0.125000 0.496188 0.871188 Ca\n0.503812 0.375000 0.628812 Ca\n0.125000 0.996188 0.371188 Ca\n0.375000 0.125000 0.750000 Mn\n0.375000 0.125000 0.250000 Mn\n0.875000 0.625000 0.750000 Mn\n0.375000 0.625000 0.750000 Mn\n0.375000 0.625000 0.250000 Mn\n0.875000 0.125000 0.250000 Mn\n0.875000 0.125000 0.750000 Mn\n0.875000 0.625000 0.250000 Mn\n0.752964 0.375000 0.877964 V\n0.125000 0.747036 0.122036 V\n0.750000 0.250000 0.500000 V\n0.250000 0.750000 0.500000 V\n0.625000 0.002964 0.877964 V\n0.497036 0.875000 0.122036 V\n0.252964 0.375000 0.377964 V\n0.125000 0.247036 0.622036 V\n0.500000 0.500000 0.000000 V\n0.000000 0.000000 0.000000 V\n0.625000 0.502964 0.377964 V\n0.997036 0.875000 0.622036 V\n0.500000 0.000000 0.500000 Ag\n0.000000 0.500000 0.500000 Ag\n0.750000 0.750000 0.000000 Ag\n0.250000 0.250000 0.000000 Ag\n0.575151 0.227388 0.462794 O\n0.766187 0.509429 0.340496 O\n0.788301 0.415738 0.058124 O\n0.574309 0.233813 0.743242 O\n0.266187 0.925691 0.256758 O\n0.272612 0.924849 0.537206 O\n0.480177 0.038301 0.872563 O\n0.668933 0.009429 0.743242 O\n0.769823 0.142387 0.058124 O\n0.772612 0.235406 0.347763 O\n0.990571 0.733813 0.659504 O\n0.165738 0.607613 0.127437 O\n0.461699 0.019823 0.127437 O\n0.075151 0.612357 0.347763 O\n0.387643 0.735406 0.462794 O\n0.892387 0.334262 0.872563 O\n0.264594 0.727388 0.652237 O\n0.084262 0.711699 0.941876 O\n0.764594 0.112357 0.537206 O\n0.581067 0.824309 0.840496 O\n0.675691 0.918933 0.159504 O\n0.357613 0.730177 0.941876 O\n0.490571 0.831067 0.256758 O\n0.862357 0.825151 0.847763 O\n0.259429 0.418933 0.243242 O\n0.887643 0.424849 0.652237 O\n0.392387 0.519823 0.558124 O\n0.074309 0.331067 0.340496 O\n0.168933 0.425691 0.659504 O\n0.985406 0.137643 0.962794 O\n0.665738 0.538301 0.558124 O\n0.485406 0.522612 0.847763 O\n0.857613 0.915738 0.627437 O\n0.362357 0.514594 0.037206 O\n0.674849 0.637643 0.152237 O\n0.288301 0.230177 0.372563 O\n0.584262 0.642387 0.372563 O\n0.759429 0.516187 0.840496 O\n0.977388 0.014594 0.152237 O\n0.980177 0.107613 0.441876 O\n0.081067 0.240571 0.756758 O\n0.269823 0.211699 0.627437 O\n0.477388 0.325151 0.962794 O\n0.483813 0.324309 0.243242 O\n0.175691 0.016187 0.756758 O\n0.961699 0.834262 0.441876 O\n0.983813 0.740571 0.159504 O\n0.174849 0.022612 0.037206 O\n",
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{
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