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{
"id": "mp-770643",
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{
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"formula_full": "Na4 Ti6 O13",
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{
"id": "mp-781502",
"created_at": "2022-09-04T14:47:55.807792Z",
"structure_string": "Li4 Mn6 B6 O18\n1.0\n5.228154 0.000000 0.000000\n0.365350 6.137125 0.000000\n2.339600 1.079513 11.710034\nLi Mn B O\n4 6 6 18\ndirect\n0.041524 0.411744 0.098958 Li\n0.371555 0.765841 0.423696 Li\n0.962778 0.591666 0.897919 Li\n0.693265 0.100988 0.756461 Li\n0.597479 0.249867 0.999796 Mn\n0.947039 0.576518 0.325091 Mn\n0.269450 0.912319 0.661203 Mn\n0.742693 0.088158 0.334697 Mn\n0.067342 0.423095 0.664752 Mn\n0.396671 0.769101 0.008905 Mn\n0.840029 0.836526 0.115110 B\n0.484129 0.477836 0.224360 B\n0.820594 0.806639 0.554082 B\n0.179994 0.186248 0.445141 B\n0.515598 0.538121 0.781740 B\n0.157656 0.148930 0.884176 B\n0.613901 0.942113 0.094360 O\n0.998781 0.721101 0.033803 O\n0.396964 0.449469 0.125362 O\n0.903234 0.844902 0.223747 O\n0.331749 0.577374 0.312896 O\n0.742966 0.407995 0.232853 O\n0.078674 0.738553 0.565092 O\n0.743645 0.777625 0.452354 O\n0.661350 0.906013 0.641294 O\n0.342437 0.073636 0.367929 O\n0.214270 0.181796 0.559077 O\n0.950642 0.296448 0.419464 O\n0.263170 0.626835 0.762690 O\n0.663169 0.414769 0.703865 O\n0.067320 0.108806 0.785801 O\n0.588477 0.567145 0.884517 O\n0.008285 0.273792 0.964133 O\n0.407383 0.072682 0.896351 O\n",
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"formula_full": "Li4 Mn6 B6 O18",
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{
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"structure_string": "Ti2 V8 Si6\n1.0\n0.000000 0.000000 -4.716187\n-4.770003 -4.770003 -2.358094\n-4.770003 4.770003 -2.358094\nTi V Si\n2 8 6\ndirect\n0.750000 0.500000 0.500000 Ti\n0.250000 0.500000 0.500000 Ti\n0.220109 0.707904 0.851878 V\n0.779891 0.292096 0.148122 V\n0.279891 0.148122 0.292096 V\n0.720109 0.851878 0.707904 V\n0.071987 0.148122 0.707904 V\n0.928013 0.851878 0.292096 V\n0.571987 0.707904 0.148122 V\n0.428013 0.292096 0.851878 V\n0.670280 0.159439 0.500000 Si\n0.329720 0.840561 0.500000 Si\n0.829720 0.500000 0.840561 Si\n0.170280 0.500000 0.159439 Si\n0.250000 0.000000 0.000000 Si\n0.750000 0.000000 0.000000 Si\n",
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"elements": [
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"density": 5.19777174719439,
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"formula_full": "Ti2 V8 Si6",
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{
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"structure_string": "Dy2 O2 F2\n1.0\n6.465904 -1.910681 0.000000\n6.465904 1.910681 0.000000\n5.901296 0.000000 3.260877\nDy O F\n2 2 2\ndirect\n0.259143 0.259143 0.259143 Dy\n0.740857 0.740857 0.740857 Dy\n0.378096 0.378096 0.378096 O\n0.621904 0.621904 0.621904 O\n0.129968 0.129968 0.129968 F\n0.870032 0.870032 0.870032 F\n",
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{
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"structure_string": "Li2 La2 C4 O12\n1.0\n3.481953 3.954325 3.772097\n3.481953 -3.954325 3.772097\n7.011065 0.000000 -0.910987\nLi La C O\n2 2 4 12\ndirect\n0.749717 0.250283 0.250000 Li\n0.250283 0.749717 0.750000 Li\n0.803561 0.196439 0.750000 La\n0.196439 0.803561 0.250000 La\n0.323996 0.210375 0.628620 C\n0.789625 0.676004 0.871380 C\n0.676004 0.789625 0.371380 C\n0.210375 0.323996 0.128620 C\n0.545005 0.208944 0.561989 O\n0.791056 0.454995 0.938011 O\n0.454995 0.791056 0.438011 O\n0.208944 0.545005 0.061989 O\n0.203139 0.035854 0.804316 O\n0.964146 0.796861 0.695684 O\n0.796861 0.964146 0.195684 O\n0.035854 0.203139 0.304316 O\n0.789271 0.617755 0.479574 O\n0.382245 0.210729 0.020426 O\n0.210729 0.382245 0.520426 O\n0.617755 0.789271 0.979574 O\n",
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{
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{
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{
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"structure_string": "Sr1 Pr3 Fe4 O12\n1.0\n7.856169 0.000000 0.000000\n0.000000 5.550273 0.000000\n0.000000 0.017326 5.611391\nSr Pr Fe O\n1 3 4 12\ndirect\n0.500000 0.494122 0.531212 Sr\n0.500000 0.013247 0.043116 Pr\n0.000000 0.507837 0.455287 Pr\n0.000000 0.992199 0.958967 Pr\n0.251320 0.499923 0.997234 Fe\n0.748928 0.001217 0.500785 Fe\n0.748680 0.499923 0.997234 Fe\n0.251072 0.001217 0.500785 Fe\n0.285632 0.204733 0.794482 O\n0.717856 0.279278 0.280767 O\n0.794784 0.783137 0.216125 O\n0.202928 0.715603 0.714256 O\n0.205216 0.783137 0.216125 O\n0.797072 0.715603 0.714256 O\n0.714368 0.204733 0.794482 O\n0.282144 0.279278 0.280767 O\n0.500000 0.581863 0.991815 O\n0.500000 0.941358 0.479514 O\n0.000000 0.423921 0.014815 O\n0.000000 0.077668 0.517977 O\n",
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