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{
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{
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{
"id": "mp-1101160",
"created_at": "2022-09-04T14:40:56.292262Z",
"structure_string": "Zr6 N4 O6\n1.0\n2.047112 5.350243 0.000000\n-2.047112 5.350243 0.000000\n0.000000 0.062946 10.748348\nZr N O\n6 4 6\ndirect\n0.855403 0.855403 0.565641 Zr\n0.854000 0.854000 0.937105 Zr\n0.806668 0.806668 0.248210 Zr\n0.193034 0.193034 0.756329 Zr\n0.141626 0.141626 0.058813 Zr\n0.137469 0.137469 0.437403 Zr\n0.701248 0.701248 0.426536 N\n0.698076 0.698076 0.080577 N\n0.764151 0.764151 0.744762 N\n0.298158 0.298158 0.925613 N\n0.954566 0.954566 0.117277 O\n0.956994 0.956994 0.381421 O\n0.046279 0.046279 0.612980 O\n0.044367 0.044367 0.883939 O\n0.304989 0.304989 0.571279 O\n0.242974 0.242974 0.252115 O\n",
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{
"id": "mp-866083",
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"structure_string": "Zr6 N4\n1.0\n5.512042 -2.840057 0.000000\n5.512042 2.840057 0.000000\n4.048715 0.000000 4.696429\nZr N\n6 4\ndirect\n0.075366 0.424634 0.750000 Zr\n0.750000 0.075366 0.424634 Zr\n0.424634 0.750000 0.075366 Zr\n0.575366 0.250000 0.924634 Zr\n0.250000 0.924634 0.575366 Zr\n0.924634 0.575366 0.250000 Zr\n0.338791 0.338791 0.338791 N\n0.161209 0.161209 0.161209 N\n0.838791 0.838791 0.838791 N\n0.661209 0.661209 0.661209 N\n",
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{
"id": "mp-704604",
"created_at": "2022-09-04T14:47:03.896789Z",
"structure_string": "Zr6 Mo12 O48\n1.0\n5.179676 -8.971462 0.000000\n5.179676 8.971462 0.000000\n0.000000 0.000000 12.075606\nZr Mo O\n6 12 48\ndirect\n0.333333 0.666667 0.985324 Zr\n0.333333 0.666667 0.514676 Zr\n0.666667 0.333333 0.014676 Zr\n0.000000 0.000000 0.000000 Zr\n0.000000 0.000000 0.500000 Zr\n0.666667 0.333333 0.485324 Zr\n0.337557 0.008217 0.853523 Mo\n0.662443 0.670660 0.353523 Mo\n0.008217 0.670660 0.146477 Mo\n0.670660 0.662443 0.853523 Mo\n0.329340 0.991783 0.353523 Mo\n0.991783 0.662443 0.646477 Mo\n0.670660 0.008217 0.646477 Mo\n0.337557 0.329340 0.646477 Mo\n0.991783 0.329340 0.853523 Mo\n0.662443 0.991783 0.146477 Mo\n0.008217 0.337557 0.353523 Mo\n0.329340 0.337557 0.146477 Mo\n0.654105 0.973703 0.289405 O\n0.161647 0.986158 0.902816 O\n0.824511 0.838353 0.902816 O\n0.159200 0.655730 0.611691 O\n0.654105 0.680401 0.210595 O\n0.344270 0.503470 0.611691 O\n0.319599 0.345895 0.289405 O\n0.973703 0.319599 0.710595 O\n0.840800 0.496530 0.111691 O\n0.324677 0.495267 0.084895 O\n0.495267 0.324677 0.584895 O\n0.495267 0.170590 0.915105 O\n0.026297 0.345895 0.210595 O\n0.655730 0.496530 0.388309 O\n0.026297 0.680401 0.289405 O\n0.175489 0.161647 0.097184 O\n0.170590 0.675323 0.084895 O\n0.159200 0.503470 0.888309 O\n0.345895 0.319599 0.789405 O\n0.675323 0.170590 0.584895 O\n0.170590 0.495267 0.415105 O\n0.161647 0.175489 0.597184 O\n0.655730 0.159200 0.111691 O\n0.319599 0.973703 0.210595 O\n0.824511 0.986158 0.597184 O\n0.496530 0.840800 0.611691 O\n0.986158 0.824511 0.097184 O\n0.504733 0.829410 0.084895 O\n0.838353 0.013842 0.097184 O\n0.013842 0.175489 0.902816 O\n0.840800 0.344270 0.388309 O\n0.675323 0.504733 0.915105 O\n0.504733 0.675323 0.415105 O\n0.013842 0.838353 0.597184 O\n0.496530 0.655730 0.888309 O\n0.324677 0.829410 0.415105 O\n0.503470 0.344270 0.111691 O\n0.838353 0.824511 0.402816 O\n0.503470 0.159200 0.388309 O\n0.829410 0.504733 0.584895 O\n0.829410 0.324677 0.915105 O\n0.986158 0.161647 0.402816 O\n0.175489 0.013842 0.402816 O\n0.680401 0.026297 0.789405 O\n0.344270 0.840800 0.888309 O\n0.973703 0.654105 0.789405 O\n0.345895 0.026297 0.710595 O\n0.680401 0.654105 0.710595 O\n",
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"formula_full": "Zr6 Mo12 O48",
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{
"id": "mp-18059",
"created_at": "2022-09-04T14:47:10.519660Z",
"structure_string": "Zr6 Mn6 Si12\n1.0\n-2.581614 3.946291 8.668014\n2.581614 -3.946291 8.668014\n2.581614 3.946291 -8.668014\nZr Mn Si\n6 6 12\ndirect\n0.353657 0.094700 0.258957 Zr\n0.646343 0.905300 0.741043 Zr\n0.164258 0.905300 0.258957 Zr\n0.835742 0.094700 0.741043 Zr\n0.641104 0.641104 0.000000 Zr\n0.358896 0.358896 0.000000 Zr\n0.500000 0.000000 0.000000 Mn\n0.500000 0.500000 0.500000 Mn\n0.000000 0.000000 0.500000 Mn\n0.000000 0.500000 0.000000 Mn\n0.247838 0.500000 0.747838 Mn\n0.752162 0.500000 0.252162 Mn\n0.000000 0.755408 0.755408 Si\n0.000000 0.244592 0.244592 Si\n0.500000 0.245456 0.745456 Si\n0.500000 0.754544 0.254544 Si\n0.201975 0.201975 0.000000 Si\n0.798025 0.798025 0.000000 Si\n0.288366 0.788366 0.500000 Si\n0.711634 0.211634 0.500000 Si\n0.713538 0.363092 0.350445 Si\n0.286462 0.636908 0.649555 Si\n0.987353 0.636908 0.350445 Si\n0.012647 0.363092 0.649555 Si\n",
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{
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"structure_string": "Zr6 Mn4 Ni8\n1.0\n-3.539958 -3.513097 -0.026852\n-0.013744 3.499689 -3.499016\n7.088733 -7.088372 -7.060145\nZr Mn Ni\n6 4 8\ndirect\n0.336200 0.664002 0.916058 Zr\n0.004123 0.002404 0.249248 Zr\n0.669763 0.330780 0.582176 Zr\n0.330237 0.669220 0.667824 Zr\n0.995877 0.997596 0.000752 Zr\n0.663800 0.335998 0.333942 Zr\n0.500000 0.500000 0.125000 Mn\n0.166871 0.832368 0.458995 Mn\n0.833129 0.167632 0.791005 Mn\n0.500000 0.000000 0.125000 Mn\n0.166579 0.332217 0.458754 Ni\n0.833421 0.667783 0.791246 Ni\n0.332876 0.667195 0.291237 Ni\n0.000000 0.000000 0.625000 Ni\n0.667124 0.332805 0.958763 Ni\n0.000000 0.500000 0.125000 Ni\n0.665581 0.832169 0.458509 Ni\n0.334419 0.167831 0.791491 Ni\n",
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{
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"structure_string": "Zr6 Mn4 Ga12\n1.0\n5.403158 0.000000 0.000000\n0.000000 7.718343 0.000000\n0.000000 0.000000 8.754732\nZr Mn Ga\n6 4 12\ndirect\n0.500000 0.152937 0.780694 Zr\n0.500000 0.152937 0.219306 Zr\n0.000000 0.847063 0.719306 Zr\n0.000000 0.847063 0.280694 Zr\n0.500000 0.719900 0.500000 Zr\n0.000000 0.280100 0.000000 Zr\n0.250000 0.500000 0.250000 Mn\n0.250000 0.500000 0.750000 Mn\n0.750000 0.500000 0.250000 Mn\n0.750000 0.500000 0.750000 Mn\n0.500000 0.763928 0.186942 Ga\n0.500000 0.763928 0.813058 Ga\n0.000000 0.236072 0.313058 Ga\n0.000000 0.236072 0.686942 Ga\n0.500000 0.367491 0.500000 Ga\n0.000000 0.632509 0.000000 Ga\n0.000000 0.563910 0.500000 Ga\n0.500000 0.436090 0.000000 Ga\n0.260321 0.043509 0.500000 Ga\n0.739679 0.043509 0.500000 Ga\n0.239679 0.956491 0.000000 Ga\n0.760321 0.956491 0.000000 Ga\n",
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{
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"structure_string": "Zr6 Mn1 Te2\n1.0\n0.000000 0.000000 -3.661536\n-3.915783 -6.782334 0.000000\n-3.915783 6.782334 0.000000\nZr Mn Te\n6 1 2\ndirect\n0.500000 0.759359 0.759359 Zr\n0.500000 0.000000 0.240641 Zr\n0.500000 0.240641 0.000000 Zr\n0.000000 0.402713 0.402713 Zr\n0.000000 0.000000 0.597287 Zr\n0.000000 0.597287 0.000000 Zr\n0.000000 0.000000 0.000000 Mn\n0.500000 0.666667 0.333333 Te\n0.500000 0.333333 0.666667 Te\n",
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{
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"structure_string": "Zr6 Mn1 Bi2\n1.0\n0.000000 0.000000 -3.705788\n-3.983495 -6.899616 0.000000\n-3.983495 6.899616 0.000000\nZr Mn Bi\n6 1 2\ndirect\n0.500000 0.763565 0.763565 Zr\n0.500000 0.000000 0.236435 Zr\n0.500000 0.236435 0.000000 Zr\n0.000000 0.390603 0.390603 Zr\n0.000000 0.000000 0.609397 Zr\n0.000000 0.609397 0.000000 Zr\n0.000000 0.000000 0.000000 Mn\n0.500000 0.666667 0.333333 Bi\n0.500000 0.333333 0.666667 Bi\n",
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