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{
"id": "oqmd-1527922",
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"structure_string": "Sr4 Ca2 Yb1 Sn1 Pb2 N2\n1.0\n2.597639 -12.651419 0.000000\n2.597639 12.651419 0.000000\n0.000000 0.000000 5.039592\nCa N Pb Sn Sr Yb\n2 2 2 1 4 1\ndirect\n0.588444 0.411556 0.000000 Ca\n0.411556 0.588444 0.000000 Ca\n0.597542 0.402458 0.500000 N\n0.402458 0.597542 0.500000 N\n0.793405 0.206595 0.000000 Pb\n0.206595 0.793405 0.000000 Pb\n0.000000 0.000000 0.000000 Sn\n0.905686 0.094314 0.500000 Sr\n0.695793 0.304207 0.500000 Sr\n0.304207 0.695793 0.500000 Sr\n0.094314 0.905686 0.500000 Sr\n0.500000 0.500000 0.500000 Yb\n",
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{
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"structure_string": "Sm2 Y2 C1 I1 Br2 Cl2\n1.0\n8.670590 -1.950298 0.000000\n8.670590 1.950298 0.000000\n-2.173766 0.000000 8.438055\nBr C Cl I Sm Y\n2 1 2 1 2 2\ndirect\n0.174496 0.174496 0.320788 Br\n0.825504 0.825504 0.679212 Br\n0.500000 0.500000 0.000000 C\n0.827806 0.827806 0.132637 Cl\n0.172194 0.172194 0.867363 Cl\n0.500000 0.500000 0.500000 I\n0.999153 0.999153 0.194169 Sm\n0.000847 0.000847 0.805831 Sm\n0.642896 0.642896 0.072405 Y\n0.357104 0.357104 0.927595 Y\n",
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{
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"structure_string": "Pr2 Y2 C1 I1 Br2 Cl2\n1.0\n9.028939 -1.951026 0.000000\n9.028939 1.951026 0.000000\n-2.105348 0.000000 8.220240\nBr C Cl I Pr Y\n2 1 2 1 2 2\ndirect\n0.833999 0.833999 0.177995 Br\n0.166001 0.166001 0.822005 Br\n0.500000 0.500000 0.000000 C\n0.155705 0.155705 0.329764 Cl\n0.844295 0.844295 0.670236 Cl\n0.500000 0.500000 0.500000 I\n0.644440 0.644440 0.080112 Pr\n0.355560 0.355560 0.919888 Pr\n0.000642 0.000642 0.193060 Y\n0.999358 0.999358 0.806940 Y\n",
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{
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"created_at": "2022-09-04T15:53:25.061803Z",
"updated_at": "2022-09-04T15:53:25.061825Z",
"structure_string": "Pr2 Sc2 C1 I2 Br2 Cl1\n1.0\n9.032301 -1.912791 0.000000\n9.032301 1.912791 0.000000\n-1.833651 0.000000 7.999828\nBr C Cl I Pr Sc\n2 1 1 2 2 2\ndirect\n0.841421 0.841421 0.197952 Br\n0.158579 0.158579 0.802048 Br\n0.500000 0.500000 0.000000 C\n0.500000 0.500000 0.500000 Cl\n0.158275 0.158275 0.371569 I\n0.841725 0.841725 0.628431 I\n0.641253 0.641253 0.068354 Pr\n0.358747 0.358747 0.931646 Pr\n0.999087 0.999087 0.186825 Sc\n0.000913 0.000913 0.813175 Sc\n",
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{
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"structure_string": "Pr2 Sc2 C1 I1 Br2 Cl2\n1.0\n8.846876 -1.896730 0.000000\n8.846876 1.896730 0.000000\n-2.011515 0.000000 7.865628\nBr C Cl I Pr Sc\n2 1 2 1 2 2\ndirect\n0.837640 0.837640 0.192057 Br\n0.162360 0.162360 0.807943 Br\n0.500000 0.500000 0.000000 C\n0.149805 0.149805 0.341498 Cl\n0.850195 0.850195 0.658502 Cl\n0.500000 0.500000 0.500000 I\n0.645404 0.645404 0.082308 Pr\n0.354596 0.354596 0.917692 Pr\n0.000805 0.000805 0.184496 Sc\n0.999195 0.999195 0.815504 Sc\n",
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{
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"structure_string": "Sr2 Ca2 Yb2 Pr1 Pb3 N2\n1.0\n2.512668 -12.097263 0.000000\n2.512668 12.097263 0.000000\n0.000000 0.000000 5.224086\nCa N Pb Pr Sr Yb\n2 2 3 1 2 2\ndirect\n0.603500 0.396500 0.000000 Ca\n0.396500 0.603500 0.000000 Ca\n0.895700 0.104300 0.000000 N\n0.104300 0.895700 0.000000 N\n0.708804 0.291196 0.500000 Pb\n0.500000 0.500000 0.500000 Pb\n0.291196 0.708804 0.500000 Pb\n0.000000 0.000000 0.000000 Pr\n0.895396 0.104604 0.500000 Sr\n0.104604 0.895396 0.500000 Sr\n0.799362 0.200638 0.000000 Yb\n0.200638 0.799362 0.000000 Yb\n",
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{
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"updated_at": "2022-09-04T15:54:37.745866Z",
"structure_string": "Dy2 Y2 Er2 Tm1 Ni2 Te2\n1.0\n-1.920016 7.793924 4.773733\n1.920016 -7.793924 4.773733\n1.920016 7.793924 -4.773733\nDy Er Ni Te Tm Y\n2 2 2 2 1 2\ndirect\n0.099836 0.746411 0.353426 Dy\n0.392985 0.746411 0.646574 Dy\n0.411829 0.096352 0.315477 Er\n0.780876 0.096352 0.684523 Er\n0.643278 0.405407 0.237871 Ni\n0.167536 0.405407 0.762129 Ni\n0.141723 0.141723 0.000000 Te\n0.740658 0.240658 0.500000 Te\n0.477241 0.477241 0.000000 Tm\n0.026444 0.895081 0.131363 Y\n0.763717 0.895081 0.868637 Y\n",
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{
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"structure_string": "Sr3 Ca2 Yb2 Sn1 Pb2 N2\n1.0\n2.595122 -12.436439 0.000000\n2.595122 12.436439 0.000000\n0.000000 0.000000 4.963119\nCa N Pb Sn Sr Yb\n2 2 2 1 3 2\ndirect\n0.699642 0.300358 0.500000 Ca\n0.300358 0.699642 0.500000 Ca\n0.608195 0.391805 0.500000 N\n0.391805 0.608195 0.500000 N\n0.791826 0.208174 0.000000 Pb\n0.208174 0.791826 0.000000 Pb\n0.000000 0.000000 0.000000 Sn\n0.899103 0.100897 0.500000 Sr\n0.500000 0.500000 0.500000 Sr\n0.100897 0.899103 0.500000 Sr\n0.598015 0.401985 0.000000 Yb\n0.401985 0.598015 0.000000 Yb\n",
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{
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"structure_string": "Pr2 Nd2 C1 I2 Br2 Cl1\n1.0\n9.422843 -2.000328 0.000000\n9.422843 2.000328 0.000000\n-1.642601 0.000000 8.194573\nBr C Cl I Nd Pr\n2 1 1 2 2 2\ndirect\n0.831589 0.831589 0.182035 Br\n0.168411 0.168411 0.817965 Br\n0.500000 0.500000 0.000000 C\n0.500000 0.500000 0.500000 Cl\n0.165215 0.165215 0.362492 I\n0.834785 0.834785 0.637508 I\n0.997155 0.997155 0.209927 Nd\n0.002845 0.002845 0.790073 Nd\n0.637784 0.637784 0.065938 Pr\n0.362216 0.362216 0.934062 Pr\n",
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"structure_string": "Sr2 Ca2 Yb2 Pr1 Pb3 N2\n1.0\n2.456312 -12.882686 0.000000\n2.456312 12.882686 0.000000\n0.000000 0.000000 4.982672\nCa N Pb Pr Sr Yb\n2 2 3 1 2 2\ndirect\n0.903466 0.096534 0.500000 Ca\n0.096534 0.903466 0.500000 Ca\n0.903799 0.096201 0.000000 N\n0.096201 0.903799 0.000000 N\n0.699108 0.300892 0.500000 Pb\n0.500000 0.500000 0.500000 Pb\n0.300892 0.699108 0.500000 Pb\n0.000000 0.000000 0.000000 Pr\n0.803115 0.196885 0.000000 Sr\n0.196885 0.803115 0.000000 Sr\n0.599286 0.400714 0.000000 Yb\n0.400714 0.599286 0.000000 Yb\n",
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{
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"structure_string": "Tb2 Nd2 Gd2 S4 N2 O2\n1.0\n7.646625 -1.945029 0.000000\n7.646625 1.945029 0.000000\n-1.724649 0.000000 9.609048\nGd N Nd O S Tb\n2 2 2 2 4 2\ndirect\n0.611073 0.611073 0.446788 Gd\n0.388927 0.388927 0.553212 Gd\n0.093521 0.093521 0.309639 N\n0.906479 0.906479 0.690361 N\n0.194948 0.194948 0.168549 Nd\n0.805052 0.805052 0.831451 Nd\n0.459606 0.459606 0.362414 O\n0.540394 0.540394 0.637586 O\n0.369774 0.369774 0.036834 S\n0.785147 0.785147 0.351246 S\n0.214853 0.214853 0.648754 S\n0.630226 0.630226 0.963166 S\n0.946373 0.946373 0.241826 Tb\n0.053627 0.053627 0.758174 Tb\n",
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{
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"structure_string": "Pr2 Sm2 C1 I1 Br2 Cl2\n1.0\n8.843555 -1.995049 0.000000\n8.843555 1.995049 0.000000\n-2.188583 0.000000 8.654258\nBr C Cl I Pr Sm\n2 1 2 1 2 2\ndirect\n0.173963 0.173963 0.318622 Br\n0.826037 0.826037 0.681378 Br\n0.500000 0.500000 0.000000 C\n0.827295 0.827295 0.133344 Cl\n0.172705 0.172705 0.866656 Cl\n0.500000 0.500000 0.500000 I\n0.998518 0.998518 0.195644 Pr\n0.001482 0.001482 0.804356 Pr\n0.644381 0.644381 0.072290 Sm\n0.355619 0.355619 0.927710 Sm\n",
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]
}