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{
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{
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"structure_string": "La12 Si4 I12\n1.0\n-6.351855 6.351855 6.351855\n6.351855 -6.351855 6.351855\n6.351855 6.351855 -6.351855\nLa Si I\n12 4 12\ndirect\n0.468826 0.484413 0.234413 La\n0.750000 0.234413 0.265587 La\n0.750000 0.015587 0.484413 La\n0.234413 0.468826 0.484413 La\n0.265587 0.750000 0.234413 La\n0.031174 0.265587 0.015587 La\n0.015587 0.031174 0.265587 La\n0.484413 0.750000 0.015587 La\n0.484413 0.234413 0.468826 La\n0.015587 0.484413 0.750000 La\n0.265587 0.015587 0.031174 La\n0.234413 0.265587 0.750000 La\n0.250000 0.250000 0.250000 Si\n0.500000 0.000000 0.250000 Si\n0.000000 0.250000 0.500000 Si\n0.250000 0.500000 0.000000 Si\n0.250000 0.759076 0.740924 I\n0.518152 0.509076 0.759076 I\n0.981848 0.740924 0.990924 I\n0.740924 0.250000 0.759076 I\n0.990924 0.981848 0.740924 I\n0.250000 0.990924 0.509076 I\n0.759076 0.518152 0.509076 I\n0.509076 0.250000 0.990924 I\n0.759076 0.740924 0.250000 I\n0.740924 0.990924 0.981848 I\n0.990924 0.509076 0.250000 I\n0.509076 0.759076 0.518152 I\n",
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{
"id": "mp-1191323",
"created_at": "2022-09-04T14:48:11.607904Z",
"structure_string": "Cu4 Mo4 O16\n1.0\n6.102334 0.007135 1.868180\n0.038138 7.024961 2.011394\n-0.009207 0.014055 7.512087\nCu Mo O\n4 4 16\ndirect\n0.185822 0.687888 0.159731 Cu\n0.814178 0.312112 0.840269 Cu\n0.807938 0.701257 0.496982 Cu\n0.192062 0.298743 0.503018 Cu\n0.783310 0.724940 0.003552 Mo\n0.216690 0.275060 0.996448 Mo\n0.215797 0.730579 0.639483 Mo\n0.784203 0.269421 0.360517 Mo\n0.144026 0.650756 0.923338 O\n0.855974 0.349244 0.076662 O\n0.497938 0.669288 0.577914 O\n0.502062 0.330712 0.422086 O\n0.861179 0.637551 0.247459 O\n0.138821 0.362449 0.752541 O\n0.499441 0.674612 0.085601 O\n0.500559 0.325388 0.914399 O\n0.130971 0.690147 0.428467 O\n0.869029 0.309853 0.571533 O\n0.785886 0.023546 0.404682 O\n0.214114 0.976454 0.595318 O\n0.798830 0.969350 0.957032 O\n0.201170 0.030650 0.042968 O\n0.858770 0.690770 0.747716 O\n0.141230 0.309230 0.252284 O\n",
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],
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"formula_full": "Cu4 Mo4 O16",
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"spacegroup": 2
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{
"id": "mp-531530",
"created_at": "2022-09-04T14:48:11.620942Z",
"structure_string": "Mg10 Al20 O40\n1.0\n23.666845 -2.885427 0.000000\n23.666845 2.885427 0.000000\n23.315058 0.000000 4.985310\nMg Al O\n10 20 40\ndirect\n0.824180 0.824180 0.824180 Mg\n0.424015 0.424015 0.424015 Mg\n0.499680 0.499680 0.499680 Mg\n0.024818 0.024818 0.024818 Mg\n0.099320 0.099320 0.099320 Mg\n0.625183 0.625183 0.625183 Mg\n0.225044 0.225044 0.225044 Mg\n0.375798 0.375798 0.375798 Mg\n0.975115 0.975115 0.975115 Mg\n0.574794 0.574794 0.574794 Mg\n0.304760 0.790608 0.304760 Al\n0.790608 0.304760 0.304760 Al\n0.304760 0.304760 0.790608 Al\n0.902721 0.394202 0.902721 Al\n0.999959 0.500274 0.500274 Al\n0.776034 0.776034 0.776034 Al\n0.700181 0.700181 0.700181 Al\n0.394202 0.902721 0.902721 Al\n0.902721 0.902721 0.394202 Al\n0.500274 0.999959 0.500274 Al\n0.599373 0.100493 0.100493 Al\n0.300199 0.300199 0.300199 Al\n0.500274 0.500274 0.999959 Al\n0.100493 0.599373 0.100493 Al\n0.194883 0.702822 0.702822 Al\n0.900390 0.900390 0.900390 Al\n0.702822 0.194883 0.702822 Al\n0.100493 0.100493 0.599373 Al\n0.702822 0.702822 0.194883 Al\n0.175296 0.175296 0.175296 Al\n0.634038 0.175941 0.634038 O\n0.452022 0.452022 0.452022 O\n0.175941 0.634038 0.634038 O\n0.634038 0.634038 0.175941 O\n0.958443 0.958443 0.438307 O\n0.234614 0.773215 0.234614 O\n0.149093 0.149093 0.149093 O\n0.052044 0.052044 0.052044 O\n0.438307 0.958443 0.958443 O\n0.773215 0.234614 0.234614 O\n0.958443 0.438307 0.958443 O\n0.234614 0.234614 0.773215 O\n0.571946 0.571946 0.009317 O\n0.830784 0.385360 0.830784 O\n0.009317 0.571946 0.571946 O\n0.750064 0.750064 0.750064 O\n0.652693 0.652693 0.652693 O\n0.385360 0.830784 0.830784 O\n0.571946 0.009317 0.571946 O\n0.830784 0.830784 0.385360 O\n0.169205 0.169205 0.614148 O\n0.430976 0.985047 0.430976 O\n0.614148 0.169205 0.169205 O\n0.985047 0.430976 0.430976 O\n0.347509 0.347509 0.347509 O\n0.252652 0.252652 0.252652 O\n0.169205 0.614148 0.169205 O\n0.430976 0.430976 0.985047 O\n0.768609 0.768609 0.215266 O\n0.030256 0.587492 0.030256 O\n0.215266 0.768609 0.768609 O\n0.852564 0.852564 0.852564 O\n0.947195 0.947195 0.947195 O\n0.587492 0.030256 0.030256 O\n0.768609 0.215266 0.768609 O\n0.030256 0.030256 0.587492 O\n0.354487 0.354487 0.845775 O\n0.546368 0.546368 0.546368 O\n0.845775 0.354487 0.354487 O\n0.354487 0.845775 0.354487 O\n",
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{
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"created_at": "2022-09-04T14:48:11.624318Z",
"structure_string": "Mn4 P8 O28\n1.0\n7.964874 0.000000 0.000000\n0.000000 7.185114 0.000000\n0.000000 3.217642 8.686828\nMn P O\n4 8 28\ndirect\n0.994904 0.732678 0.246250 Mn\n0.494904 0.267322 0.253750 Mn\n0.505096 0.732678 0.746250 Mn\n0.005096 0.267322 0.753750 Mn\n0.300713 0.674630 0.053822 P\n0.800713 0.325370 0.446178 P\n0.760495 0.924102 0.944927 P\n0.260495 0.075898 0.555073 P\n0.739505 0.924102 0.444927 P\n0.239505 0.075898 0.055073 P\n0.199287 0.674630 0.553822 P\n0.699287 0.325370 0.946178 P\n0.352830 0.890677 0.055597 O\n0.805039 0.803823 0.112197 O\n0.113964 0.646817 0.099710 O\n0.922693 0.461221 0.330571 O\n0.815839 0.326419 0.611288 O\n0.422693 0.538779 0.169429 O\n0.613964 0.353183 0.400290 O\n0.143369 0.207097 0.607234 O\n0.915042 0.002920 0.841514 O\n0.305039 0.196177 0.387803 O\n0.684161 0.326419 0.111288 O\n0.852830 0.109323 0.444403 O\n0.415042 0.997080 0.658486 O\n0.356631 0.207097 0.107234 O\n0.643369 0.792903 0.892766 O\n0.584958 0.002920 0.341514 O\n0.147170 0.890677 0.555597 O\n0.315839 0.673581 0.888712 O\n0.694961 0.803823 0.612197 O\n0.084958 0.997080 0.158486 O\n0.856631 0.792903 0.392766 O\n0.386036 0.646817 0.599710 O\n0.577307 0.461221 0.830571 O\n0.184161 0.673581 0.388712 O\n0.077307 0.538779 0.669429 O\n0.886036 0.353183 0.900290 O\n0.194961 0.196177 0.887803 O\n0.647170 0.109323 0.944403 O\n",
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{
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{
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"structure_string": "Ru2 I2\n1.0\n2.014966 -3.490024 0.000000\n2.014966 3.490024 0.000000\n0.000000 0.000000 7.428975\nRu I\n2 2\ndirect\n0.666667 0.333333 0.865312 Ru\n0.333333 0.666667 0.365312 Ru\n0.666667 0.333333 0.509688 I\n0.333333 0.666667 0.009688 I\n",
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