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{
"id": "mp-1100950",
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"structure_string": "V17 Pb3 O32\n1.0\n3.159707 0.209912 1.310865\n0.452295 10.420920 6.169404\n-1.693203 -1.601698 17.945417\nV Pb O\n17 3 32\ndirect\n0.116102 0.440049 0.302013 V\n0.335255 0.098093 0.382454 V\n0.149653 0.230904 0.753110 V\n0.136229 0.961564 0.276834 V\n0.679316 0.142323 0.128132 V\n0.349026 0.542301 0.411902 V\n0.110441 0.712329 0.790470 V\n0.670616 0.620167 0.147881 V\n0.366526 0.357430 0.855944 V\n0.902151 0.277631 0.221090 V\n0.696047 0.508230 0.578607 V\n0.334775 0.867265 0.870508 V\n0.910407 0.031408 0.713026 V\n0.884556 0.759119 0.245125 V\n0.689793 0.876245 0.629822 V\n0.894701 0.549593 0.711978 V\n0.025793 0.804980 0.444108 V\n0.523722 0.490164 0.997710 Pb\n0.504940 0.960680 0.029732 Pb\n0.461980 0.244638 0.539980 Pb\n0.214072 0.361775 0.955858 O\n0.113144 0.132255 0.178692 O\n0.175145 0.127136 0.470617 O\n0.181301 0.874700 0.969119 O\n0.099239 0.614493 0.198883 O\n0.302024 0.264281 0.295497 O\n0.503482 0.306264 0.136224 O\n0.110934 0.628252 0.494959 O\n0.137248 0.425734 0.642796 O\n0.291536 0.039027 0.785912 O\n0.246451 0.781654 0.320186 O\n0.520430 0.038627 0.635626 O\n0.484445 0.785968 0.161831 O\n0.117109 0.872923 0.680384 O\n0.287327 0.535755 0.790174 O\n0.537029 0.400013 0.379183 O\n0.448106 0.611029 0.632494 O\n0.728861 0.447854 0.223003 O\n0.920310 0.092750 0.329914 O\n0.552699 0.211535 0.829249 O\n0.507488 0.907523 0.391932 O\n0.786650 0.213335 0.675426 O\n0.736081 0.959359 0.211864 O\n0.900166 0.594074 0.342281 O\n0.798570 0.446553 0.497074 O\n0.503097 0.696450 0.871504 O\n0.714533 0.714540 0.720411 O\n0.934024 0.373435 0.800563 O\n0.833644 0.125170 0.035012 O\n0.839073 0.867139 0.532575 O\n0.906480 0.868759 0.822076 O\n0.820870 0.613871 0.050957 O\n",
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{
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"structure_string": "Cr2 F6\n1.0\n4.973587 4.088239 10.375207\n-0.716498 2.893881 4.551263\n-3.980425 -5.977688 -2.921619\nCr F\n2 6\ndirect\n0.000000 0.500000 0.000000 Cr\n0.000000 0.000000 0.000000 Cr\n0.740317 0.095939 0.848406 F\n0.851409 0.250000 0.702819 F\n0.108089 0.404061 0.848406 F\n0.259683 0.904061 0.151594 F\n0.148591 0.750000 0.297181 F\n0.891911 0.595939 0.151594 F\n",
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},
{
"id": "mp-1220996",
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"structure_string": "Na1 P4 Ru2 O14\n1.0\n4.857651 0.000000 0.000000\n-2.069813 6.773937 0.000000\n-0.370506 -0.278053 8.027834\nNa P Ru O\n1 4 2 14\ndirect\n0.437817 0.988282 0.019409 Na\n0.466365 0.368964 0.239732 P\n0.533247 0.633464 0.760622 P\n0.880198 0.761372 0.305148 P\n0.119724 0.239943 0.696637 P\n0.999058 0.499573 0.000033 Ru\n0.500197 0.000923 0.500873 Ru\n0.613134 0.333261 0.079899 O\n0.384281 0.668507 0.919837 O\n0.311563 0.458541 0.650466 O\n0.688799 0.542390 0.350341 O\n0.686648 0.899828 0.305600 O\n0.311161 0.100003 0.694894 O\n0.619414 0.814561 0.657179 O\n0.381025 0.184538 0.339814 O\n0.194839 0.433100 0.202351 O\n0.804497 0.569076 0.799228 O\n0.020879 0.247882 0.876190 O\n0.983619 0.754021 0.126231 O\n0.877908 0.200736 0.560185 O\n0.121629 0.801033 0.441334 O\n",
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{
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"created_at": "2022-09-04T14:41:06.660475Z",
"structure_string": "La2 Al24 O38\n1.0\n5.651910 -0.000396 -0.000009\n-2.826301 4.880859 0.000116\n-0.000039 0.000514 22.358894\nLa Al O\n2 24 38\ndirect\n0.334297 0.667785 0.748108 La\n0.666607 0.332163 0.248079 La\n0.167889 0.833218 0.608482 Al\n0.169752 0.831445 0.892302 Al\n0.333801 0.666282 0.190290 Al\n0.333951 0.667384 0.026094 Al\n0.333729 0.666018 0.310640 Al\n0.333973 0.667295 0.474030 Al\n0.001717 0.002787 0.761954 Al\n0.000288 0.000078 0.000099 Al\n0.999126 0.997146 0.262034 Al\n0.000192 0.999942 0.500187 Al\n0.168004 0.335212 0.608565 Al\n0.169792 0.338640 0.892056 Al\n0.662794 0.831509 0.892230 Al\n0.666290 0.833343 0.608507 Al\n0.334717 0.166713 0.108493 Al\n0.338432 0.168548 0.392404 Al\n0.831240 0.661287 0.392165 Al\n0.667362 0.333657 0.690184 Al\n0.667576 0.333959 0.810617 Al\n0.666566 0.332663 0.526173 Al\n0.666655 0.332682 0.974036 Al\n0.832960 0.664848 0.108571 Al\n0.833043 0.166671 0.108483 Al\n0.831295 0.168568 0.392363 Al\n0.155750 0.844185 0.051795 O\n0.154320 0.845434 0.446771 O\n0.009541 0.504757 0.650745 O\n0.009971 0.505130 0.850043 O\n0.184133 0.820326 0.251193 O\n0.154862 0.308987 0.446789 O\n0.000745 0.000361 0.849267 O\n0.333555 0.666652 0.557118 O\n0.000351 0.999697 0.146850 O\n0.000431 0.999667 0.349349 O\n0.000632 0.000319 0.646814 O\n0.333740 0.666795 0.943257 O\n0.496768 0.992408 0.650305 O\n0.496349 0.991557 0.850276 O\n0.181214 0.360595 0.251304 O\n0.156281 0.311828 0.051844 O\n0.637245 0.819902 0.251214 O\n0.311532 0.155816 0.551801 O\n0.308773 0.154502 0.946679 O\n0.496566 0.504577 0.650640 O\n0.496442 0.504964 0.850083 O\n0.504840 0.494915 0.350153 O\n0.504851 0.495196 0.150841 O\n0.688985 0.844132 0.051832 O\n0.691808 0.845464 0.446742 O\n0.363568 0.179578 0.751065 O\n0.504804 0.008410 0.350368 O\n0.666938 0.333162 0.443407 O\n0.504429 0.007602 0.150403 O\n0.820778 0.639460 0.751177 O\n0.666932 0.333354 0.057177 O\n0.844393 0.688213 0.551864 O\n0.845835 0.691070 0.946702 O\n0.817430 0.180276 0.751084 O\n0.992042 0.495406 0.150725 O\n0.991601 0.495081 0.350185 O\n0.844864 0.155950 0.551844 O\n0.846377 0.154529 0.946643 O\n",
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"formula_full": "La2 Al24 O38",
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{
"id": "mp-1094090",
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"structure_string": "Ni4 N1\n1.0\n3.715139 0.000000 0.000000\n0.000000 3.715139 0.000000\n0.000000 0.000000 3.715139\nNi N\n4 1\ndirect\n0.000000 0.000000 0.000000 Ni\n0.500000 0.500000 0.000000 Ni\n0.500000 0.000000 0.500000 Ni\n0.000000 0.500000 0.500000 Ni\n0.500000 0.500000 0.500000 N\n",
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"density": 8.056378888739687,
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{
"id": "mp-1220516",
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"structure_string": "Nd4 Mn2 Cr2 O12\n1.0\n5.775342 0.000000 0.000000\n0.000000 5.536723 0.000000\n0.000000 5.480805 7.645947\nNd Mn Cr O\n4 2 2 12\ndirect\n0.560621 0.735338 0.750236 Nd\n0.060621 0.264662 0.749764 Nd\n0.439379 0.264662 0.249764 Nd\n0.939379 0.735338 0.250236 Nd\n0.500000 0.000000 0.000000 Mn\n0.000000 0.000000 0.500000 Mn\n0.500000 0.500000 0.500000 Cr\n0.000000 0.500000 0.000000 Cr\n0.805025 0.257613 0.950106 O\n0.305025 0.742387 0.549894 O\n0.204874 0.348073 0.453003 O\n0.704874 0.651927 0.046997 O\n0.194975 0.742387 0.049894 O\n0.694975 0.257613 0.450106 O\n0.795126 0.651927 0.546997 O\n0.295126 0.348073 0.953003 O\n0.972082 0.849979 0.743993 O\n0.472082 0.150021 0.756007 O\n0.027918 0.150021 0.256007 O\n0.527918 0.849979 0.243993 O\n",
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"formula_full": "Nd4 Mn2 Cr2 O12",
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{
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"formula_full": "Li5 Co3 O8",
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{
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"structure_string": "Sr2 Gd1 V1 O6\n1.0\n0.000000 -4.132393 -4.132393\n4.132393 0.000000 -4.132393\n4.132393 -4.132393 0.000000\nSr Gd V O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750000 0.750000 0.750000 Sr\n0.000000 0.000000 0.000000 Gd\n0.500000 0.500000 0.500000 V\n0.729944 0.270056 0.270056 O\n0.270056 0.729944 0.729944 O\n0.729944 0.270056 0.729944 O\n0.270056 0.729944 0.270056 O\n0.729944 0.729944 0.270056 O\n0.270056 0.270056 0.729944 O\n",
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{
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"structure_string": "Li1 Ni9 O13\n1.0\n2.904632 0.000208 -0.000310\n-1.452233 4.845755 -0.777215\n-0.001287 0.017440 16.783247\nLi Ni O\n1 9 13\ndirect\n0.422923 0.844579 0.771772 Li\n0.499587 0.999406 0.486434 Ni\n0.659586 0.318501 0.061184 Ni\n0.369145 0.737692 0.977551 Ni\n0.748616 0.497582 0.401454 Ni\n0.255707 0.511583 0.564608 Ni\n0.947528 0.894062 0.135463 Ni\n0.087833 0.175029 0.891835 Ni\n0.995875 0.992186 0.329084 Ni\n0.021293 0.042352 0.651554 Ni\n0.010200 0.020055 0.031146 O\n0.880260 0.759310 0.230587 O\n0.089644 0.178823 0.771991 O\n0.308934 0.616982 0.085977 O\n0.718079 0.434850 0.945862 O\n0.575359 0.149425 0.162672 O\n0.454140 0.907856 0.882371 O\n0.609958 0.219934 0.303076 O\n0.393938 0.787411 0.661389 O\n0.385577 0.771536 0.374176 O\n0.622891 0.246200 0.597041 O\n0.121571 0.243483 0.440893 O\n0.863021 0.726163 0.512716 O\n",
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{
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},
{
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"elements": [
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"formula_full": "Li1 V2 H4 O2 F10",
"formula_reduced": "LiV2H4(OF5)2",
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},
{
"id": "mp-731755",
"created_at": "2022-09-04T14:41:07.153238Z",
"structure_string": "Mo6 N2 O18\n1.0\n3.878981 7.770077 0.000000\n-3.878981 7.770077 0.000000\n0.000000 0.454550 6.437147\nMo N O\n6 2 18\ndirect\n0.876852 0.876852 0.645002 Mo\n0.123148 0.123148 0.354998 Mo\n0.197557 0.680463 0.270296 Mo\n0.680463 0.197557 0.270296 Mo\n0.802443 0.319537 0.729704 Mo\n0.319537 0.802443 0.729704 Mo\n0.683787 0.683787 0.172401 N\n0.316213 0.316213 0.827599 N\n0.250935 0.749065 0.000000 O\n0.749065 0.250935 0.000000 O\n0.154859 0.684502 0.578426 O\n0.684502 0.154859 0.578426 O\n0.845141 0.315498 0.421574 O\n0.315498 0.845141 0.421574 O\n0.093984 0.575214 0.212852 O\n0.575214 0.093984 0.212852 O\n0.906016 0.424786 0.787148 O\n0.424786 0.906016 0.787148 O\n0.961428 0.961428 0.297027 O\n0.038572 0.038572 0.702973 O\n0.779851 0.779851 0.534497 O\n0.220149 0.220149 0.465503 O\n0.853601 0.853601 0.908684 O\n0.146399 0.146399 0.091316 O\n0.460450 0.460450 0.298203 O\n0.539550 0.539550 0.701797 O\n",
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"volume": 388.0309772119165,
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"formula_full": "Mo6 N2 O18",
"formula_reduced": "Mo3NO9",
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"updated_at": "2021-11-28T01:35:08.143000Z",
"spacegroup": 12
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]
}