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{
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"structure_string": "Na12 Zn12 As12 O48\n1.0\n8.418767 0.000000 0.000000\n0.000000 9.102969 0.000000\n0.000000 9.045087 15.974101\nNa Zn As O\n12 12 12 48\ndirect\n0.469569 0.702510 0.570369 Na\n0.969569 0.297490 0.929631 Na\n0.530431 0.297490 0.429631 Na\n0.030431 0.702510 0.070369 Na\n0.037227 0.648072 0.588038 Na\n0.537227 0.351928 0.911962 Na\n0.962773 0.351928 0.411962 Na\n0.462773 0.648072 0.088038 Na\n0.040497 0.001905 0.754804 Na\n0.540497 0.998095 0.745196 Na\n0.959503 0.998095 0.245196 Na\n0.459503 0.001905 0.254804 Na\n0.836867 0.656844 0.907860 Zn\n0.336867 0.343156 0.592140 Zn\n0.163133 0.343156 0.092140 Zn\n0.663133 0.656844 0.407860 Zn\n0.833139 0.017465 0.579305 Zn\n0.333139 0.982535 0.920695 Zn\n0.166861 0.982535 0.420695 Zn\n0.666861 0.017465 0.079305 Zn\n0.329458 0.679811 0.741361 Zn\n0.829458 0.320189 0.758639 Zn\n0.670542 0.320189 0.258639 Zn\n0.170542 0.679811 0.241361 Zn\n0.229350 0.650253 0.910877 As\n0.729350 0.349747 0.589123 As\n0.770650 0.349747 0.089123 As\n0.270650 0.650253 0.410877 As\n0.776797 0.971717 0.420532 As\n0.276797 0.028283 0.079468 As\n0.223203 0.028283 0.579468 As\n0.723203 0.971717 0.920532 As\n0.724460 0.687622 0.732705 As\n0.224460 0.312378 0.767295 As\n0.275540 0.312378 0.267295 As\n0.775540 0.687622 0.232705 As\n0.742523 0.472158 0.796576 O\n0.242523 0.527842 0.703424 O\n0.257477 0.527842 0.203424 O\n0.757477 0.472158 0.296576 O\n0.745387 0.781301 0.794297 O\n0.245387 0.218699 0.705703 O\n0.254613 0.218699 0.205703 O\n0.754613 0.781301 0.294297 O\n0.733551 0.437501 0.983177 O\n0.233551 0.562499 0.516823 O\n0.266449 0.562499 0.016823 O\n0.766449 0.437501 0.483177 O\n0.725114 0.132865 0.633015 O\n0.225114 0.867135 0.866985 O\n0.274886 0.867135 0.366985 O\n0.774886 0.132865 0.133015 O\n0.050719 0.580220 0.893618 O\n0.550719 0.419780 0.606382 O\n0.949281 0.419780 0.106382 O\n0.449281 0.580220 0.393618 O\n0.956403 0.869755 0.452779 O\n0.371719 0.594631 0.861117 O\n0.628281 0.405369 0.138883 O\n0.128281 0.594631 0.361117 O\n0.866321 0.817060 0.949995 O\n0.366321 0.182940 0.550005 O\n0.133679 0.182940 0.050005 O\n0.633679 0.817060 0.449995 O\n0.220320 0.901091 0.686880 O\n0.720320 0.098909 0.813120 O\n0.779680 0.098909 0.313120 O\n0.279680 0.901091 0.186880 O\n0.738972 0.094350 0.466530 O\n0.238972 0.905650 0.033470 O\n0.261028 0.905650 0.533470 O\n0.761028 0.094350 0.966530 O\n0.638901 0.770909 0.152081 O\n0.138901 0.229091 0.347919 O\n0.361099 0.229091 0.847919 O\n0.861099 0.770909 0.652081 O\n0.958901 0.743669 0.184928 O\n0.458901 0.256331 0.315072 O\n0.041099 0.256331 0.815072 O\n0.541099 0.743669 0.684928 O\n0.543597 0.869755 0.952779 O\n0.043597 0.130245 0.547221 O\n0.456403 0.130245 0.047221 O\n0.871719 0.405369 0.638883 O\n",
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{
"id": "mp-16956",
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{
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"structure_string": "V6 H6 O18\n1.0\n4.955421 0.000000 -0.950054\n0.000000 8.772322 0.000000\n-0.587088 0.000000 7.976719\nV H O\n6 6 18\ndirect\n0.475582 0.441342 0.182823 V\n0.524418 0.941342 0.817177 V\n0.527124 0.552771 0.818310 V\n0.472876 0.052771 0.181690 V\n0.943100 0.246662 0.075326 V\n0.056900 0.746662 0.924674 V\n0.095818 0.157384 0.592031 H\n0.836776 0.243219 0.434768 H\n0.088056 0.339835 0.582672 H\n0.904182 0.657384 0.407969 H\n0.163224 0.743219 0.565232 H\n0.911944 0.839835 0.417328 H\n0.677593 0.406329 0.002752 O\n0.322407 0.906329 0.997248 O\n0.325774 0.588849 0.000018 O\n0.674226 0.088849 0.999982 O\n0.161702 0.394219 0.229993 O\n0.838298 0.894219 0.770007 O\n0.841522 0.599573 0.770332 O\n0.158478 0.099573 0.229668 O\n0.642604 0.245956 0.257938 O\n0.357396 0.745956 0.742062 O\n0.118679 0.246466 0.930575 O\n0.881321 0.746466 0.069425 O\n0.649130 0.549334 0.341105 O\n0.350870 0.049334 0.658895 O\n0.356042 0.443974 0.660691 O\n0.643958 0.943974 0.339309 O\n0.963113 0.247276 0.561140 O\n0.036887 0.747276 0.438860 O\n",
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{
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{
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{
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"structure_string": "Ag8 B40 H48 N16 Cl40\n1.0\n15.084616 0.000000 0.000000\n0.000000 12.532203 0.000000\n0.000000 0.000000 14.014372\nAg B H N Cl\n8 40 48 16 40\ndirect\n0.705897 0.101654 0.936559 Ag\n0.794103 0.398346 0.436559 Ag\n0.205897 0.398346 0.063441 Ag\n0.294103 0.101654 0.563441 Ag\n0.294103 0.898346 0.063441 Ag\n0.205897 0.601654 0.563441 Ag\n0.794103 0.601654 0.936559 Ag\n0.705897 0.898346 0.436559 Ag\n0.387035 0.259161 0.300438 B\n0.112965 0.240839 0.800438 B\n0.887035 0.240839 0.699562 B\n0.612965 0.259161 0.199562 B\n0.612965 0.740839 0.699562 B\n0.887035 0.759161 0.199562 B\n0.112965 0.759161 0.300438 B\n0.387035 0.740839 0.800438 B\n0.484012 0.297455 0.350483 B\n0.015988 0.202545 0.850483 B\n0.984012 0.202545 0.649517 B\n0.515988 0.297455 0.149517 B\n0.515988 0.702545 0.649517 B\n0.984012 0.797455 0.149517 B\n0.015988 0.797455 0.350483 B\n0.484012 0.702545 0.850483 B\n0.577584 0.219111 0.308457 B\n0.922416 0.280889 0.808457 B\n0.077584 0.280889 0.691543 B\n0.422416 0.219111 0.191543 B\n0.422416 0.780889 0.691543 B\n0.077584 0.719111 0.191543 B\n0.922416 0.719111 0.308457 B\n0.577584 0.780889 0.808457 B\n0.559243 0.355316 0.261676 B\n0.940757 0.144684 0.761676 B\n0.059243 0.144684 0.738324 B\n0.440757 0.355316 0.238324 B\n0.440757 0.644684 0.738324 B\n0.059243 0.855316 0.238324 B\n0.940757 0.855316 0.261676 B\n0.559243 0.644684 0.761676 B\n0.465542 0.162270 0.303261 B\n0.034458 0.337730 0.803261 B\n0.965542 0.337730 0.696739 B\n0.534458 0.162270 0.196739 B\n0.534458 0.837730 0.696739 B\n0.965542 0.662270 0.196739 B\n0.034458 0.662270 0.303261 B\n0.465542 0.837730 0.803261 B\n0.801749 0.946265 0.026535 H\n0.698251 0.553735 0.526535 H\n0.301749 0.553735 0.973465 H\n0.198251 0.946265 0.473465 H\n0.198251 0.053735 0.973465 H\n0.301749 0.446265 0.473465 H\n0.698251 0.446265 0.026535 H\n0.801749 0.053735 0.526535 H\n0.859403 0.057165 0.028841 H\n0.640597 0.442835 0.528841 H\n0.359403 0.442835 0.971159 H\n0.140597 0.057165 0.471159 H\n0.140597 0.942835 0.971159 H\n0.359403 0.557165 0.471159 H\n0.640597 0.557165 0.028841 H\n0.859403 0.942835 0.528841 H\n0.777480 0.038755 0.105092 H\n0.722520 0.461245 0.605092 H\n0.277480 0.461245 0.894908 H\n0.222520 0.038755 0.394908 H\n0.222520 0.961245 0.894908 H\n0.277480 0.538755 0.394908 H\n0.722520 0.538755 0.105092 H\n0.777480 0.961245 0.605092 H\n0.588598 0.120220 0.791223 H\n0.911402 0.379780 0.291223 H\n0.088598 0.379780 0.208777 H\n0.411402 0.120220 0.708777 H\n0.411402 0.879780 0.208777 H\n0.088598 0.620220 0.708777 H\n0.911402 0.620220 0.791223 H\n0.588598 0.879780 0.291223 H\n0.563047 0.211484 0.872287 H\n0.936953 0.288516 0.372287 H\n0.063047 0.288516 0.127713 H\n0.436953 0.211484 0.627713 H\n0.436953 0.788516 0.127713 H\n0.063047 0.711484 0.627713 H\n0.936953 0.711484 0.872287 H\n0.563047 0.788516 0.372287 H\n0.645647 0.232831 0.796774 H\n0.854353 0.267169 0.296774 H\n0.145647 0.267169 0.203226 H\n0.354353 0.232831 0.703226 H\n0.354353 0.767169 0.203226 H\n0.145647 0.732831 0.703226 H\n0.854353 0.732831 0.796774 H\n0.645647 0.767169 0.296774 H\n0.796737 0.027038 0.035993 N\n0.703263 0.472962 0.535993 N\n0.296737 0.472962 0.964007 N\n0.203263 0.027038 0.464007 N\n0.203263 0.972962 0.964007 N\n0.296737 0.527038 0.464007 N\n0.703263 0.527038 0.035993 N\n0.796737 0.972962 0.535993 N\n0.614219 0.176203 0.836817 N\n0.885781 0.323797 0.336817 N\n0.114219 0.323797 0.163183 N\n0.385781 0.176203 0.663183 N\n0.385781 0.823797 0.163183 N\n0.114219 0.676203 0.663183 N\n0.885781 0.676203 0.836817 N\n0.614219 0.823797 0.336817 N\n0.277682 0.261441 0.349060 Cl\n0.222318 0.238559 0.849060 Cl\n0.777682 0.238559 0.650940 Cl\n0.722318 0.261441 0.150940 Cl\n0.722318 0.738559 0.650940 Cl\n0.777682 0.761441 0.150940 Cl\n0.222318 0.761441 0.349060 Cl\n0.277682 0.738559 0.849060 Cl\n0.485768 0.345999 0.471962 Cl\n0.014232 0.154001 0.971962 Cl\n0.985768 0.154001 0.528038 Cl\n0.514232 0.345999 0.028038 Cl\n0.514232 0.654001 0.528038 Cl\n0.985768 0.845999 0.028038 Cl\n0.014232 0.845999 0.471962 Cl\n0.485768 0.654001 0.971962 Cl\n0.656189 0.168701 0.393906 Cl\n0.843811 0.331299 0.893906 Cl\n0.156189 0.331299 0.606094 Cl\n0.343811 0.168701 0.106094 Cl\n0.343811 0.831299 0.606094 Cl\n0.156189 0.668701 0.106094 Cl\n0.843811 0.668701 0.393906 Cl\n0.656189 0.831299 0.893906 Cl\n0.614231 0.479872 0.287111 Cl\n0.885769 0.020128 0.787111 Cl\n0.114231 0.020128 0.712889 Cl\n0.385769 0.479872 0.212889 Cl\n0.385769 0.520128 0.712889 Cl\n0.114231 0.979872 0.212889 Cl\n0.885769 0.979872 0.287111 Cl\n0.614231 0.520128 0.787111 Cl\n0.442255 0.037589 0.362672 Cl\n0.057745 0.462411 0.862672 Cl\n0.942255 0.462411 0.637328 Cl\n0.557745 0.037589 0.137328 Cl\n0.557745 0.962411 0.637328 Cl\n0.942255 0.537589 0.137328 Cl\n0.057745 0.537589 0.362672 Cl\n0.442255 0.962411 0.862672 Cl\n",
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