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{
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{
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{
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"structure_string": "P4 H24 N4 O16\n1.0\n7.226268 0.000000 0.000000\n0.000000 8.062958 0.000000\n0.000000 0.000000 8.112752\nP H N O\n4 24 4 16\ndirect\n0.495104 0.037411 0.450679 P\n0.004896 0.962589 0.950679 P\n0.504896 0.537411 0.049321 P\n0.995104 0.462589 0.549321 P\n0.751511 0.701092 0.110029 H\n0.842215 0.960310 0.413175 H\n0.248489 0.201092 0.389971 H\n0.979944 0.860783 0.550647 H\n0.826716 0.582991 0.345323 H\n0.042174 0.567555 0.937374 H\n0.420181 0.016818 0.909606 H\n0.748489 0.298908 0.610029 H\n0.173284 0.082991 0.154677 H\n0.157785 0.460310 0.086825 H\n0.957826 0.067555 0.562626 H\n0.520056 0.139217 0.050647 H\n0.079819 0.983182 0.409606 H\n0.542174 0.932445 0.062626 H\n0.657785 0.039690 0.913175 H\n0.342215 0.539690 0.586825 H\n0.479944 0.639217 0.449353 H\n0.673284 0.417009 0.845323 H\n0.920181 0.483182 0.090394 H\n0.251511 0.798908 0.889971 H\n0.579819 0.516818 0.590394 H\n0.326716 0.917009 0.654677 H\n0.020056 0.360783 0.949353 H\n0.457826 0.432445 0.437374 H\n0.965534 0.967946 0.483693 N\n0.465534 0.532054 0.516307 N\n0.034466 0.467946 0.016307 N\n0.534466 0.032054 0.983693 N\n0.587172 0.390000 0.936180 O\n0.815350 0.399314 0.654956 O\n0.087172 0.110000 0.063820 O\n0.623200 0.951113 0.332019 O\n0.067098 0.320092 0.447189 O\n0.123200 0.548887 0.667981 O\n0.684650 0.600686 0.154956 O\n0.315350 0.100686 0.345044 O\n0.376800 0.451113 0.167981 O\n0.432902 0.679908 0.947189 O\n0.876800 0.048887 0.832019 O\n0.184650 0.899314 0.845044 O\n0.567098 0.179908 0.552811 O\n0.912828 0.610000 0.436180 O\n0.932902 0.820092 0.052811 O\n0.412828 0.890000 0.563820 O\n",
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{
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"structure_string": "La1 Pt3\n1.0\n4.238156 0.000000 0.000000\n0.000000 4.238156 0.000000\n0.000000 0.000000 4.238156\nLa Pt\n1 3\ndirect\n0.000000 0.000000 0.000000 La\n0.000000 0.500000 0.500000 Pt\n0.500000 0.500000 0.000000 Pt\n0.500000 0.000000 0.500000 Pt\n",
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{
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{
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"structure_string": "K16 Li4 H12 S16 O64\n1.0\n7.508422 0.000000 0.000000\n0.000000 7.508422 0.000000\n0.000000 0.000000 29.067655\nK Li H S O\n16 4 12 16 64\ndirect\n0.014135 0.490387 0.773952 K\n0.985865 0.509613 0.273952 K\n0.490387 0.985865 0.523952 K\n0.509613 0.014135 0.023952 K\n0.400149 0.374280 0.647816 K\n0.599851 0.625720 0.147816 K\n0.374280 0.599851 0.397816 K\n0.625720 0.400149 0.897816 K\n0.920203 0.903136 0.884076 K\n0.079797 0.096864 0.384076 K\n0.903136 0.079797 0.634076 K\n0.096864 0.920203 0.134076 K\n0.506613 0.787125 0.783569 K\n0.493387 0.212875 0.283569 K\n0.787125 0.493387 0.533569 K\n0.212875 0.506613 0.033569 K\n0.264320 0.148477 0.834573 Li\n0.735680 0.851523 0.334573 Li\n0.148477 0.735680 0.584573 Li\n0.851523 0.264320 0.084573 Li\n0.704639 0.694176 0.691153 H\n0.295361 0.305824 0.191153 H\n0.694176 0.295361 0.441153 H\n0.305824 0.704639 0.941153 H\n0.215410 0.942139 0.706437 H\n0.784590 0.057861 0.206437 H\n0.942139 0.784590 0.456437 H\n0.057861 0.215410 0.956437 H\n0.722282 0.184837 0.729948 H\n0.277718 0.815163 0.229948 H\n0.184837 0.277718 0.479948 H\n0.815163 0.722282 0.979948 H\n0.895013 0.543835 0.649879 S\n0.104987 0.456165 0.149879 S\n0.543835 0.104987 0.399879 S\n0.456165 0.895013 0.899879 S\n0.428661 0.890098 0.651188 S\n0.571339 0.109902 0.151188 S\n0.890098 0.571339 0.401188 S\n0.109902 0.428661 0.901188 S\n0.990510 0.980688 0.766912 S\n0.009490 0.019312 0.266912 S\n0.980688 0.009490 0.516912 S\n0.019312 0.990510 0.016912 S\n0.523970 0.325257 0.771925 S\n0.476030 0.674743 0.271925 S\n0.325257 0.476030 0.521925 S\n0.674743 0.523970 0.021925 S\n0.817049 0.620315 0.696640 O\n0.182951 0.379685 0.196640 O\n0.620315 0.182951 0.446640 O\n0.379685 0.817049 0.946640 O\n0.757359 0.431199 0.628733 O\n0.242641 0.568801 0.128733 O\n0.431199 0.242641 0.378733 O\n0.568801 0.757359 0.878733 O\n0.051337 0.443215 0.664226 O\n0.948663 0.556785 0.164226 O\n0.443215 0.948663 0.414226 O\n0.556785 0.051337 0.914226 O\n0.935496 0.699724 0.620766 O\n0.064504 0.300276 0.120766 O\n0.699724 0.064504 0.370766 O\n0.300276 0.935496 0.870766 O\n0.264783 0.989435 0.671899 O\n0.735217 0.010565 0.171899 O\n0.989435 0.735217 0.421899 O\n0.010565 0.264783 0.921899 O\n0.363959 0.748344 0.620204 O\n0.636041 0.251656 0.120204 O\n0.748344 0.636041 0.370204 O\n0.251656 0.363959 0.870204 O\n0.528166 0.812365 0.690348 O\n0.471834 0.187635 0.190348 O\n0.812365 0.471834 0.440348 O\n0.187635 0.528166 0.940348 O\n0.530167 0.025217 0.625758 O\n0.469833 0.974783 0.125758 O\n0.025217 0.469833 0.375758 O\n0.974783 0.530167 0.875758 O\n0.045623 0.114747 0.801821 O\n0.954377 0.885253 0.301821 O\n0.114747 0.954377 0.551821 O\n0.885253 0.045623 0.051821 O\n0.879054 0.843172 0.788788 O\n0.120946 0.156828 0.288788 O\n0.843172 0.120946 0.538788 O\n0.156828 0.879054 0.038788 O\n0.897214 0.072414 0.728236 O\n0.102786 0.927586 0.228236 O\n0.072414 0.102786 0.478236 O\n0.927586 0.897214 0.978236 O\n0.154961 0.889808 0.747135 O\n0.845039 0.110192 0.247135 O\n0.889808 0.845039 0.497135 O\n0.110192 0.154961 0.997135 O\n0.657545 0.434205 0.795899 O\n0.342455 0.565795 0.295899 O\n0.434205 0.342455 0.545899 O\n0.565795 0.657545 0.045899 O\n0.608563 0.258863 0.724919 O\n0.391437 0.741137 0.224919 O\n0.258863 0.391437 0.474919 O\n0.741137 0.608563 0.974919 O\n0.478510 0.163867 0.798310 O\n0.521490 0.836133 0.298310 O\n0.163867 0.521490 0.548310 O\n0.836133 0.478510 0.048310 O\n0.368852 0.428372 0.757192 O\n0.631148 0.571628 0.257192 O\n0.428372 0.631148 0.507192 O\n0.571628 0.368852 0.007192 O\n",
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{
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}