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{
"id": "jvasp-31888",
"created_at": "2022-09-04T14:37:12.485101Z",
"updated_at": "2022-09-04T14:37:12.485119Z",
"structure_string": "Mo2 Se4 Cl24\n1.0\n8.064573 0.020631 -2.719102\n-1.733330 7.876124 -2.719102\n-0.010549 -0.013157 12.106578\nMo Se Cl\n2 4 24\ndirect\n0.123354 0.623354 0.246708 Mo\n0.873354 0.873354 0.746708 Mo\n0.935725 0.994844 0.413116 Se\n0.244844 0.685725 0.913116 Se\n0.477389 0.418271 0.413116 Se\n0.668271 0.227388 0.913116 Se\n0.594802 0.756730 0.593577 Cl\n0.239200 0.422701 0.907201 Cl\n0.067066 0.246046 0.567125 Cl\n0.758595 0.912367 0.907364 Cl\n0.086847 0.748775 0.093577 Cl\n0.148767 0.994996 0.907364 Cl\n0.496046 0.817066 0.067125 Cl\n0.908433 0.080706 0.253795 Cl\n0.399839 0.585846 0.247418 Cl\n0.734500 0.418000 0.407201 Cl\n0.847578 0.661571 0.247418 Cl\n0.345361 0.173088 0.253795 Cl\n0.571079 0.250059 0.067125 Cl\n0.668000 0.484500 0.907201 Cl\n0.672701 0.989200 0.407201 Cl\n0.330706 0.658433 0.753795 Cl\n0.998774 0.836846 0.593578 Cl\n0.500059 0.321078 0.567125 Cl\n0.835846 0.149839 0.747418 Cl\n0.162367 0.508596 0.407364 Cl\n0.244996 0.898767 0.407364 Cl\n0.006730 0.344802 0.093577 Cl\n0.423088 0.095361 0.753795 Cl\n0.911571 0.597578 0.747418 Cl\n",
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{
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"structure_string": "Ca2 Cl4 O12\n1.0\n0.000000 5.718871 3.584874\n5.993633 0.000000 3.584874\n5.993633 5.718871 0.000000\nCa Cl O\n2 4 12\ndirect\n0.997201 0.997200 0.002799 Ca\n0.247201 0.247201 0.252799 Ca\n0.597419 0.024542 0.514177 Cl\n0.386137 0.735823 0.225458 Cl\n0.735823 0.386137 0.652581 Cl\n0.024542 0.597419 0.863863 Cl\n0.148199 0.389791 0.851077 O\n0.639067 0.398922 0.860209 O\n0.269840 0.971908 0.137266 O\n0.818332 0.644342 0.426988 O\n0.644342 0.818332 0.110337 O\n0.389791 0.148198 0.610933 O\n0.398923 0.639066 0.101802 O\n0.139664 0.823011 0.605657 O\n0.823012 0.139663 0.431667 O\n0.629015 0.112734 0.278091 O\n0.971908 0.269840 0.620985 O\n0.112734 0.629015 0.980159 O\n",
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{
"id": "jvasp-11195",
"created_at": "2022-09-04T14:37:14.448916Z",
"updated_at": "2022-09-04T14:37:14.448941Z",
"structure_string": "Hf2 P4 S12\n1.0\n6.767944 -0.069067 -1.223836\n-2.870420 6.129480 -1.223836\n-0.064959 -0.101007 11.476161\nHf P S\n2 4 12\ndirect\n0.599463 0.099463 0.198926 Hf\n0.849463 0.849463 0.698925 Hf\n0.636900 0.513016 0.376772 P\n0.739871 0.863755 0.376771 P\n0.613755 0.989871 0.876771 P\n0.263016 0.886901 0.876772 P\n0.662465 0.712444 0.860643 S\n0.198179 0.148198 0.860643 S\n0.987653 0.034605 0.537981 S\n0.550327 0.503375 0.537981 S\n0.784605 0.237653 0.037981 S\n0.376188 0.318444 0.227040 S\n0.850851 0.908595 0.227040 S\n0.658594 0.100851 0.727040 S\n0.068444 0.626188 0.727040 S\n0.462444 0.912465 0.360643 S\n0.898198 0.448178 0.360643 S\n0.253375 0.800327 0.037981 S\n",
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{
"id": "jvasp-57829",
"created_at": "2022-09-04T14:37:16.458995Z",
"updated_at": "2022-09-04T14:37:16.459020Z",
"structure_string": "Na2 Ag2 N4 O8\n1.0\n6.106376 -0.103884 -2.214843\n-2.992965 5.323606 -2.214843\n0.130809 0.219306 6.734666\nNa Ag N O\n2 2 4 8\ndirect\n0.763575 0.236426 0.500001 Na\n0.513575 0.486426 0.000001 Na\n0.249144 0.750858 0.500001 Ag\n0.999144 0.000857 0.000001 Ag\n0.519375 0.480627 0.500001 N\n0.269374 0.730626 0.000001 N\n0.793944 0.206058 0.000001 N\n0.043943 0.956058 0.500001 N\n0.791260 0.329819 0.186868 O\n0.670183 0.208741 0.813135 O\n0.854394 0.892952 0.313135 O\n0.410338 0.502917 0.320732 O\n0.107050 0.145607 0.686867 O\n0.067814 0.660394 0.820732 O\n0.497084 0.589664 0.679271 O\n0.339607 0.932187 0.179271 O\n",
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{
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"created_at": "2022-09-04T14:37:27.365594Z",
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"structure_string": "Na8 V4 O12\n1.0\n5.461339 0.000861 -0.000813\n-1.744151 5.175272 -0.000076\n-1.857164 -2.587234 9.115792\nNa V O\n8 4 12\ndirect\n0.994812 0.494319 0.987617 Na\n0.428565 0.428764 0.844648 Na\n0.833473 0.333716 0.654526 Na\n0.256741 0.256266 0.511557 Na\n0.743956 0.743493 0.487617 Na\n0.666466 0.166820 0.344647 Na\n0.571412 0.571772 0.154530 Na\n0.505940 0.005466 0.011557 Na\n0.153543 0.646396 0.328471 V\n0.074675 0.067515 0.170702 V\n0.932740 0.925540 0.828468 V\n0.353860 0.846635 0.670703 V\n0.807180 0.806863 0.005009 O\n0.662218 0.116388 0.812160 O\n0.159836 0.704937 0.808229 O\n0.601185 0.646292 0.690939 O\n0.099634 0.053833 0.687017 O\n0.448780 0.948468 0.505010 O\n0.051744 0.551438 0.494163 O\n0.946376 0.900638 0.312164 O\n0.353895 0.399087 0.308225 O\n0.295268 0.840455 0.190949 O\n0.883796 0.338069 0.187005 O\n0.193373 0.193047 0.994166 O\n",
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{
"id": "jvasp-54708",
"created_at": "2022-09-04T14:37:27.678758Z",
"updated_at": "2022-09-04T14:37:27.678782Z",
"structure_string": "H4 S2 O8\n1.0\n3.765948 2.282686 -1.735845\n-3.765948 2.282686 1.735845\n-0.422623 0.000000 8.988499\nH S O\n4 2 8\ndirect\n0.500002 0.245622 0.136449 H\n0.245622 0.500002 0.363551 H\n0.363845 0.882143 0.863508 H\n0.882143 0.363844 0.636492 H\n0.852884 0.852883 0.750000 S\n0.102512 0.102512 0.250000 S\n0.602860 0.777168 0.829440 O\n0.777169 0.602860 0.670561 O\n0.307363 0.304762 0.113355 O\n0.304762 0.307362 0.386645 O\n0.194428 0.918429 0.886580 O\n0.918430 0.194427 0.613421 O\n0.773066 0.106273 0.170659 O\n0.106273 0.773065 0.329341 O\n",
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{
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"created_at": "2022-09-04T14:37:30.715452Z",
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"structure_string": "Ir2 F8\n1.0\n5.261353 -0.051685 -1.418787\n-3.007603 4.317272 -1.418787\n0.028181 0.053337 5.622496\nIr F\n2 8\ndirect\n0.745518 0.245519 0.500000 Ir\n0.995519 0.995519 -0.000001 Ir\n0.972103 0.727297 0.165720 F\n0.561576 0.806383 0.834280 F\n0.042530 0.296712 0.328439 F\n0.968274 0.714093 0.671561 F\n0.046712 0.292530 0.828439 F\n0.464091 0.218274 0.171561 F\n0.556382 0.811576 0.334279 F\n0.477297 0.222103 0.665721 F\n",
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{
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"structure_string": "P4 O10\n1.0\n4.795927 -0.036850 -0.800585\n-2.196747 4.263399 -0.800585\n0.022838 0.037137 8.623645\nP O\n4 10\ndirect\n0.737919 0.403579 0.350832 P\n0.052748 0.387087 0.649169 P\n0.153579 0.987920 0.850832 P\n0.137086 0.302747 0.149169 P\n0.915356 0.745302 0.390741 O\n0.354563 0.524616 0.609261 O\n0.495303 0.165356 0.890741 O\n0.274615 0.604562 0.109261 O\n-0.002835 -0.002835 -0.000000 O\n0.747166 0.247166 0.500001 O\n0.845885 0.215264 0.224896 O\n0.990369 0.620990 0.775106 O\n0.965265 0.095885 0.724897 O\n0.370989 0.240369 0.275105 O\n",
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{
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"structure_string": "K2 P2 H4 O8\n1.0\n6.031160 -0.018319 -1.917538\n-3.230934 5.092770 -1.917538\n-0.001843 -0.003341 6.291257\nK P H O\n2 2 4 8\ndirect\n0.750853 0.750853 -0.000001 K\n0.500853 0.000853 0.500000 K\n0.234563 0.234562 -0.000000 P\n0.984563 0.484562 0.500000 P\n0.967672 0.398177 0.124014 H\n0.274164 0.843658 0.875986 H\n0.148178 0.217672 0.624014 H\n0.593658 0.524163 0.375986 H\n0.786545 0.520258 0.571120 O\n0.949137 0.215425 0.428880 O\n0.270258 0.036545 0.071120 O\n0.965425 0.199137 0.928880 O\n0.273141 0.702989 0.732163 O\n0.970828 0.540977 0.267837 O\n0.452989 0.523140 0.232162 O\n0.290978 0.220827 0.767838 O\n",
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{
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"structure_string": "Cr2 P2 O8\n1.0\n4.583069 -0.000023 2.619435\n-2.308386 5.742315 1.329665\n-0.033646 -0.000002 5.278774\nCr P O\n2 2 8\ndirect\n0.817090 0.250001 0.817091 Cr\n0.567092 0.750002 0.567091 Cr\n0.131670 0.250002 0.131673 P\n0.881670 0.750001 0.881670 P\n0.711347 0.633489 0.236907 O\n0.818845 0.070468 0.220991 O\n0.077860 0.366512 0.370393 O\n0.236907 0.866516 0.711345 O\n0.748365 0.929527 0.791468 O\n0.220993 0.429533 0.818844 O\n0.791465 0.570472 0.748369 O\n0.370393 0.133489 0.077865 O\n",
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},
{
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"created_at": "2022-09-04T14:38:00.251819Z",
"updated_at": "2022-09-04T14:38:00.251838Z",
"structure_string": "Li8 V4 O8 F4\n1.0\n2.944536 4.148818 -0.000986\n-2.944536 4.148818 0.000986\n-2.941450 0.000000 8.779089\nLi V O F\n8 4 8 4\ndirect\n0.110537 0.639511 0.721115 Li\n0.360489 0.889464 0.221115 Li\n0.054025 0.196202 0.607847 Li\n0.205963 0.044052 0.911919 Li\n0.803799 0.945975 0.107847 Li\n0.955949 0.794038 0.411919 Li\n0.619285 0.130756 0.738457 Li\n0.869245 0.380716 0.238457 Li\n0.458001 0.292001 0.415984 V\n0.302346 0.447670 0.104688 V\n0.707999 0.542000 0.915984 V\n0.552331 0.697654 0.604689 V\n0.381682 0.859746 0.752233 O\n0.764395 0.958821 0.575757 O\n0.311342 0.465389 0.575766 O\n0.140255 0.618319 0.252233 O\n0.870553 0.388036 0.752241 O\n0.041180 0.235606 0.075757 O\n0.534611 0.688659 0.075766 O\n0.611965 0.129448 0.252241 O\n0.715068 0.535530 0.422007 F\n0.464470 0.284932 0.922007 F\n0.957566 0.793045 0.921985 F\n0.206955 0.042434 0.421985 F\n",
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{
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"created_at": "2022-09-04T14:38:05.419969Z",
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"structure_string": "Li2 Ni2 P2 O8\n1.0\n-2.767532 4.634724 0.000000\n2.767532 0.000000 5.518389\n2.767532 4.634724 0.000000\nLi Ni P O\n2 2 2 8\ndirect\n0.806525 0.250000 0.806525 Li\n0.556525 0.750000 0.556525 Li\n0.442892 0.250000 0.442891 Ni\n0.192892 0.750000 0.192892 Ni\n0.121659 0.250000 0.121658 P\n0.871658 0.750000 0.871658 P\n0.777687 0.104415 0.269979 O\n0.294773 0.088897 0.161484 O\n0.750383 0.588897 0.205876 O\n0.874394 0.604415 0.673271 O\n0.161484 0.411104 0.294773 O\n0.269979 0.395585 0.777686 O\n0.673272 0.895585 0.874393 O\n0.205876 0.911104 0.750382 O\n",
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}
]
}