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"structure_string": "Se8 O16\n1.0\n4.566124 0.000000 0.000000\n0.000000 5.164127 0.000000\n0.000000 0.000000 14.671749\nSe O\n8 16\ndirect\n0.528514 0.500000 0.751762 Se\n0.950918 0.500000 0.003838 Se\n0.081476 0.000000 0.193604 Se\n0.330224 0.000000 0.940730 Se\n0.918523 0.000000 0.693604 Se\n0.669776 0.000000 0.440730 Se\n0.049081 0.500000 0.503838 Se\n0.471485 0.500000 0.251762 Se\n0.945417 0.748656 0.419348 O\n0.471326 0.000000 0.837118 O\n0.597070 0.500000 0.982673 O\n0.528673 0.000000 0.337118 O\n0.402929 0.500000 0.482673 O\n0.178765 0.500000 0.724356 O\n0.937115 0.000000 0.090519 O\n0.062884 0.000000 0.590519 O\n0.821234 0.500000 0.224355 O\n0.643227 0.749745 0.670103 O\n0.945417 0.251344 0.419348 O\n0.054582 0.748656 0.919348 O\n0.643227 0.250256 0.670103 O\n0.356772 0.250256 0.170103 O\n0.054582 0.251344 0.919348 O\n0.356772 0.749745 0.170103 O\n",
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{
"id": "jvasp-51016",
"created_at": "2022-09-04T14:37:20.088670Z",
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"structure_string": "Ba2 H8 O6\n1.0\n0.000000 3.994171 -0.028831\n5.784386 0.000000 0.000000\n0.000000 -0.051976 -7.171507\nBa H O\n2 8 6\ndirect\n-0.000009 0.193666 0.683432 Ba\n0.000008 0.693666 0.316568 Ba\n0.799172 0.205347 0.125621 H\n0.200806 0.205341 0.125602 H\n0.200826 0.705347 0.874379 H\n0.799193 0.705342 0.874398 H\n0.499991 0.407586 -0.022642 H\n0.500009 0.907587 0.022642 H\n0.500080 0.596636 0.592326 H\n0.499919 0.096636 0.407674 H\n0.000007 0.194515 0.212842 O\n-0.000008 0.694515 0.787158 O\n0.499985 0.237754 0.967814 O\n0.500013 0.737755 0.032186 O\n0.500022 0.455789 0.516515 O\n0.499977 0.955790 0.483486 O\n",
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{
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"structure_string": "Sr2 Ca2 C4 O12\n1.0\n5.290251 0.000000 0.000000\n0.000000 6.432407 0.000000\n0.000000 0.000000 7.315047\nSr Ca C O\n2 2 4 12\ndirect\n0.000000 0.112407 0.255679 Sr\n0.000000 0.887594 0.755680 Sr\n0.500000 0.482120 0.549420 Ca\n0.500000 0.517880 0.049420 Ca\n0.500000 0.962269 0.076696 C\n0.500000 0.037731 0.576696 C\n0.000000 0.587619 0.338053 C\n0.000000 0.412381 0.838053 C\n0.000000 0.241114 0.924481 O\n0.210757 0.506912 0.795769 O\n0.500000 0.151979 0.134371 O\n0.711475 0.137319 0.551882 O\n0.711475 0.862681 0.051882 O\n0.288524 0.862681 0.051882 O\n0.210757 0.493088 0.295768 O\n0.789242 0.506912 0.795769 O\n0.500000 0.848021 0.634371 O\n0.789242 0.493088 0.295768 O\n0.000000 0.758886 0.424480 O\n0.288524 0.137319 0.551882 O\n",
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"structure_string": "H8 C2 S2 N4\n1.0\n7.868447 0.000000 0.000000\n0.000000 6.368566 0.000000\n0.000000 0.000000 4.851540\nH C S N\n8 2 2 4\ndirect\n0.698209 0.177499 0.115120 H\n0.698209 0.822501 0.115120 H\n0.198209 0.822501 0.884880 H\n0.198209 0.177499 0.884880 H\n0.567681 0.316245 0.877097 H\n0.567681 0.683756 0.877097 H\n0.067681 0.683756 0.122903 H\n0.067681 0.316245 0.122903 H\n0.549773 0.000000 0.850262 C\n0.049772 0.000000 0.149738 C\n0.401986 0.000000 0.594883 S\n-0.098014 0.000000 0.405117 S\n0.611331 0.179567 -0.043726 N\n0.611331 0.820433 -0.043726 N\n0.111331 0.820433 0.043726 N\n0.111331 0.179567 0.043726 N\n",
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{
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"created_at": "2022-09-04T14:37:43.849399Z",
"updated_at": "2022-09-04T14:37:43.849417Z",
"structure_string": "Se4 O8\n1.0\n4.550999 0.000000 0.000000\n0.000000 5.164537 0.000000\n0.000000 0.000000 7.378405\nSe O\n4 8\ndirect\n0.744175 0.500000 0.003131 Se\n0.873706 0.000000 0.381032 Se\n0.255825 0.500000 0.503131 Se\n0.126294 0.000000 0.881032 Se\n0.266902 0.000000 0.674294 O\n0.149044 0.251236 0.336430 O\n0.850956 0.251236 0.836430 O\n0.610229 0.500000 0.458484 O\n0.389771 0.500000 0.958485 O\n0.149044 0.748764 0.336430 O\n0.733098 0.000000 0.174294 O\n0.850956 0.748764 0.836430 O\n",
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{
"id": "jvasp-54698",
"created_at": "2022-09-04T14:37:48.497841Z",
"updated_at": "2022-09-04T14:37:48.497851Z",
"structure_string": "Mn4 H2 O8\n1.0\n2.925216 0.000000 0.000000\n0.000000 4.641169 0.000000\n0.000000 0.000000 9.623033\nMn H O\n4 2 8\ndirect\n0.000000 0.212245 0.635749 Mn\n0.000000 0.787755 0.135749 Mn\n0.500001 0.292635 0.356787 Mn\n0.500001 0.707365 0.856787 Mn\n0.000000 0.707337 0.472582 H\n0.000000 0.292663 0.972582 H\n0.000000 0.494960 0.463699 O\n0.000000 0.505040 0.963698 O\n0.500001 0.048825 0.524253 O\n0.500001 0.951175 0.024253 O\n0.000000 0.906463 0.774180 O\n0.000000 0.093537 0.274180 O\n0.500001 0.593434 0.222570 O\n0.500001 0.406566 0.722569 O\n",
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{
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"structure_string": "Sr2 Ta2 N2 O4\n1.0\n4.003464 -0.000000 0.000000\n0.000000 5.795170 0.000000\n-0.000000 -0.000000 5.785614\nSr Ta N O\n2 2 2 4\ndirect\n0.499999 0.762559 0.516524 Sr\n0.499999 0.237441 0.016524 Sr\n-0.000000 0.734821 0.015130 Ta\n-0.000000 0.265179 0.515130 Ta\n-0.000000 0.485067 0.762163 N\n-0.000000 0.514933 0.262163 N\n0.499999 0.771614 0.988870 O\n-0.000000 0.978685 0.717353 O\n-0.000000 0.021314 0.217353 O\n0.499999 0.228386 0.488870 O\n",
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{
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"structure_string": "Fe4 H4 O8\n1.0\n0.000000 2.903543 -0.029268\n9.897508 0.000000 0.000000\n0.000000 -0.045717 -4.493083\nFe H O\n4 4 8\ndirect\n-0.000094 0.616686 0.711292 Fe\n0.000093 0.116686 0.288707 Fe\n0.499988 0.345758 0.760119 Fe\n0.500010 0.845758 0.239881 Fe\n0.000083 0.359767 0.234129 H\n-0.000084 0.859767 0.765871 H\n0.499851 0.583937 0.173351 H\n0.500147 0.083937 0.826649 H\n0.000066 0.288539 0.068671 O\n-0.000067 0.788539 0.931328 O\n0.499872 0.678284 0.468136 O\n0.500125 0.178284 0.531864 O\n-0.000058 0.439779 0.545712 O\n0.000057 0.939779 0.454287 O\n0.499911 0.548291 0.960819 O\n0.500087 0.048291 0.039181 O\n",
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{
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{
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]
}