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{
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{
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{
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{
"id": "mp-19224",
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"structure_string": "Ca6 Mn2 Zn2 O12\n1.0\n4.487101 -4.648951 0.000000\n4.487101 4.648951 0.000000\n-0.329537 0.000000 6.452769\nCa Mn Zn O\n6 2 2 12\ndirect\n0.250000 0.613180 0.886820 Ca\n0.386820 0.113180 0.750000 Ca\n0.113180 0.750000 0.386820 Ca\n0.750000 0.386820 0.113180 Ca\n0.613180 0.886820 0.250000 Ca\n0.886820 0.250000 0.613180 Ca\n0.500000 0.500000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.750000 0.750000 0.750000 Zn\n0.250000 0.250000 0.250000 Zn\n0.546033 0.215359 0.417149 O\n0.453967 0.784641 0.582851 O\n0.784641 0.582851 0.453967 O\n0.582851 0.453967 0.784641 O\n0.715359 0.046033 0.917149 O\n0.046033 0.917149 0.715359 O\n0.082851 0.284641 0.953967 O\n0.953967 0.082851 0.284641 O\n0.284641 0.953967 0.082851 O\n0.417149 0.546033 0.215359 O\n0.215359 0.417149 0.546033 O\n0.917149 0.715359 0.046033 O\n",
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{
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"created_at": "2022-09-04T14:42:42.959025Z",
"structure_string": "K12 Ga52\n1.0\n3.262664 -8.187680 0.000000\n3.262664 8.187680 0.000000\n0.000000 0.000000 28.904055\nK Ga\n12 52\ndirect\n0.786640 0.213360 0.086731 K\n0.011554 0.988446 0.138408 K\n0.638295 0.361705 0.180590 K\n0.011554 0.988446 0.361592 K\n0.786640 0.213360 0.413269 K\n0.988446 0.011554 0.638408 K\n0.638295 0.361705 0.319410 K\n0.988446 0.011554 0.861592 K\n0.361705 0.638295 0.680590 K\n0.361705 0.638295 0.819410 K\n0.213360 0.786640 0.586731 K\n0.213360 0.786640 0.913269 K\n0.143214 0.244396 0.034944 Ga\n0.244396 0.143214 0.534944 Ga\n0.143214 0.244396 0.465056 Ga\n0.244396 0.143214 0.965056 Ga\n0.030729 0.370240 0.296646 Ga\n0.030729 0.370240 0.203354 Ga\n0.370240 0.030729 0.703354 Ga\n0.370240 0.030729 0.796646 Ga\n0.258304 0.316587 0.250000 Ga\n0.316587 0.258304 0.750000 Ga\n0.405455 0.187204 0.047526 Ga\n0.405455 0.187204 0.452474 Ga\n0.187204 0.405455 0.547526 Ga\n0.187204 0.405455 0.952474 Ga\n0.428058 0.571942 0.171631 Ga\n0.341525 0.658475 0.031095 Ga\n0.201284 0.798716 0.072157 Ga\n0.482582 0.517418 0.089354 Ga\n0.658475 0.341525 0.531095 Ga\n0.259333 0.740667 0.156129 Ga\n0.341525 0.658475 0.468905 Ga\n0.259333 0.740667 0.343871 Ga\n0.482582 0.517418 0.410646 Ga\n0.571942 0.428058 0.671631 Ga\n0.201284 0.798716 0.427843 Ga\n0.517418 0.482582 0.589354 Ga\n0.078822 0.921178 0.250000 Ga\n0.798716 0.201284 0.572157 Ga\n0.740667 0.259333 0.656129 Ga\n0.921178 0.078822 0.750000 Ga\n0.428058 0.571942 0.328369 Ga\n0.767883 0.232117 0.750000 Ga\n0.571942 0.428058 0.828369 Ga\n0.740667 0.259333 0.843871 Ga\n0.232117 0.767883 0.250000 Ga\n0.798716 0.201284 0.927843 Ga\n0.658475 0.341525 0.968905 Ga\n0.517418 0.482582 0.910646 Ga\n0.812796 0.594545 0.047526 Ga\n0.594545 0.812796 0.547526 Ga\n0.812796 0.594545 0.452474 Ga\n0.594545 0.812796 0.952474 Ga\n0.683413 0.741696 0.250000 Ga\n0.741696 0.683413 0.750000 Ga\n0.629760 0.969271 0.203354 Ga\n0.629760 0.969271 0.296646 Ga\n0.969271 0.629760 0.796646 Ga\n0.969271 0.629760 0.703354 Ga\n0.755604 0.856786 0.034944 Ga\n0.856786 0.755604 0.534944 Ga\n0.755604 0.856786 0.465056 Ga\n0.856786 0.755604 0.965056 Ga\n",
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{
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"structure_string": "Ba4 Al8 Ge8\n1.0\n4.324749 0.000000 0.000000\n0.000000 10.293518 0.000000\n0.000000 0.000000 11.089052\nBa Al Ge\n4 8 8\ndirect\n0.750000 0.251829 0.674901 Ba\n0.750000 0.751829 0.825099 Ba\n0.250000 0.748171 0.325099 Ba\n0.250000 0.248171 0.174901 Ba\n0.250000 0.042909 0.881594 Al\n0.750000 0.898861 0.546999 Al\n0.750000 0.457091 0.381594 Al\n0.750000 0.398861 0.953001 Al\n0.250000 0.601139 0.046999 Al\n0.250000 0.542909 0.618406 Al\n0.750000 0.957091 0.118406 Al\n0.250000 0.101139 0.453001 Al\n0.250000 0.354371 0.459746 Ge\n0.750000 0.645629 0.540254 Ge\n0.250000 0.475645 0.843213 Ge\n0.750000 0.524355 0.156787 Ge\n0.750000 0.024355 0.343213 Ge\n0.250000 0.854371 0.040254 Ge\n0.250000 0.975645 0.656787 Ge\n0.750000 0.145629 0.959746 Ge\n",
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{
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"structure_string": "Mn2 H32 C8 N2 O4 F8\n1.0\n2.805888 8.131759 0.000000\n-2.805888 8.131759 0.000000\n0.000000 1.487676 10.768802\nMn H C N O F\n2 32 8 2 4 8\ndirect\n0.000000 0.500000 0.500000 Mn\n0.500000 0.000000 0.000000 Mn\n0.256821 0.210487 0.274979 H\n0.789513 0.743179 0.225021 H\n0.743179 0.789513 0.725021 H\n0.210487 0.256821 0.774979 H\n0.411760 0.016814 0.387767 H\n0.983186 0.588240 0.112233 H\n0.588240 0.983186 0.612233 H\n0.016814 0.411760 0.887767 H\n0.790481 0.395284 0.094829 H\n0.604716 0.209519 0.405171 H\n0.209519 0.604716 0.905171 H\n0.395284 0.790481 0.594829 H\n0.001551 0.196870 0.219735 H\n0.803130 0.998449 0.280265 H\n0.998449 0.803130 0.780265 H\n0.196870 0.001551 0.719735 H\n0.960602 0.079068 0.122288 H\n0.920932 0.039398 0.377712 H\n0.039398 0.920932 0.877712 H\n0.079068 0.960602 0.622288 H\n0.470529 0.707197 0.257984 H\n0.292803 0.529471 0.242016 H\n0.529471 0.292803 0.742016 H\n0.707197 0.470529 0.757984 H\n0.397442 0.614204 0.386577 H\n0.385796 0.602558 0.113423 H\n0.602558 0.385796 0.613423 H\n0.614204 0.397442 0.886577 H\n0.695757 0.481547 0.375846 H\n0.518453 0.304243 0.124154 H\n0.304243 0.518453 0.624154 H\n0.481547 0.695757 0.875846 H\n0.867383 0.247096 0.164876 C\n0.752904 0.132617 0.335124 C\n0.132617 0.752904 0.835124 C\n0.247096 0.867383 0.664876 C\n0.546885 0.553074 0.323579 C\n0.446926 0.453115 0.176421 C\n0.453115 0.446926 0.676421 C\n0.553074 0.546885 0.823579 C\n0.654156 0.345844 0.250000 N\n0.345844 0.654156 0.750000 N\n0.238786 0.182449 0.364553 O\n0.817551 0.761214 0.135447 O\n0.761214 0.817551 0.635447 O\n0.182449 0.238786 0.864553 O\n0.149526 0.574450 0.439480 F\n0.425550 0.850474 0.060520 F\n0.850474 0.425550 0.560520 F\n0.574449 0.149526 0.939480 F\n0.740126 0.740968 0.380815 F\n0.259032 0.259874 0.119185 F\n0.259874 0.259032 0.619185 F\n0.740968 0.740126 0.880815 F\n",
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