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{
"id": "jvasp-110828",
"created_at": "2022-09-04T14:38:36.955848Z",
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"structure_string": "Mn1 Tc2 As1\n1.0\n3.697759 0.000000 2.134902\n1.232586 3.486280 2.134902\n0.000000 0.000000 4.269804\nMn Tc As\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Mn\n0.250000 0.250000 0.249999 Tc\n0.750001 0.750000 0.749998 Tc\n0.500001 0.500000 0.499999 As\n",
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{
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"structure_string": "Tb4 Cr4 B16\n1.0\n3.477538 0.000000 0.000000\n0.000000 5.930783 0.000000\n0.000000 0.000000 11.463000\nTb Cr B\n4 4 16\ndirect\n0.000000 0.123809 0.849234 Tb\n0.000000 0.876190 0.150766 Tb\n0.000000 0.376191 0.349234 Tb\n0.000000 0.623809 0.650766 Tb\n0.000000 0.121140 0.578919 Cr\n0.000000 0.878859 0.421081 Cr\n0.000000 0.378860 0.078919 Cr\n0.000000 0.621140 0.921081 Cr\n0.500000 0.525298 0.191214 B\n0.500000 0.474701 0.808786 B\n0.500000 0.886993 0.546612 B\n0.500000 0.113007 0.453388 B\n0.500000 0.613007 0.046612 B\n0.500000 0.386993 0.953388 B\n0.500000 0.862020 0.967434 B\n0.500000 0.779398 0.816324 B\n0.500000 0.637979 0.467434 B\n0.500000 0.362020 0.532566 B\n0.500000 0.025299 0.308786 B\n0.500000 0.220602 0.183676 B\n0.500000 0.720602 0.316324 B\n0.500000 0.279398 0.683676 B\n0.500000 0.137980 0.032566 B\n0.500000 0.974701 0.691214 B\n",
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{
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"structure_string": "Cd1 H10 C7 O4\n1.0\n4.105906 0.049216 0.455266\n1.047223 4.051418 0.743044\n0.009757 0.008135 10.890858\nCd H C O\n1 10 7 4\ndirect\n0.759003 0.206795 0.173106 Cd\n0.048885 0.390749 0.616190 H\n0.887023 0.021510 0.719348 H\n0.892716 0.639080 0.812044 H\n0.508975 0.434743 0.752280 H\n0.502419 0.816246 0.657328 H\n0.943751 0.148617 0.911998 H\n0.379181 0.018995 0.863899 H\n0.873687 0.800257 0.449552 H\n0.128224 0.032593 0.485812 H\n0.465946 0.328859 0.550524 H\n0.347632 0.727556 0.348301 C\n0.133433 0.783094 0.469946 C\n0.248296 0.516688 0.583277 C\n0.347649 0.642927 0.693576 C\n0.049675 0.810121 0.776424 C\n0.147348 0.937651 0.888234 C\n0.201873 0.672499 0.002248 C\n0.974242 0.693566 0.093859 O\n0.291597 0.964744 0.254731 O\n0.574185 0.458732 0.344419 O\n0.464687 0.431502 0.000932 O\n",
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{
"id": "jvasp-93668",
"created_at": "2022-09-04T14:36:06.663080Z",
"updated_at": "2022-09-04T14:36:06.663104Z",
"structure_string": "U2 Ti1 H3\n1.0\n0.000000 0.000000 -3.706502\n-2.383787 -4.128839 0.000000\n-2.380482 4.126931 0.000000\nU Ti H\n2 1 3\ndirect\n0.500000 0.333225 0.666503 U\n0.500000 0.666723 0.333497 U\n0.000000 0.999965 0.000001 Ti\n0.000000 0.500020 0.500040 H\n0.000000 0.999981 0.499961 H\n0.000000 0.499988 0.000000 H\n",
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{
"id": "jvasp-103971",
"created_at": "2022-09-04T14:36:33.673047Z",
"updated_at": "2022-09-04T14:36:33.673083Z",
"structure_string": "Cd1 H10 C7 O4\n1.0\n4.051693 0.116408 0.171455\n0.909172 4.220582 0.347954\n-0.082799 -0.010086 10.637026\nCd H C O\n1 10 7 4\ndirect\n0.928158 0.954312 0.840095 Cd\n0.572236 0.313293 0.400205 H\n0.925618 0.428664 0.238873 H\n0.922566 0.780761 0.144015 H\n0.996122 0.912377 0.349546 H\n0.406216 0.855983 0.282644 H\n0.539180 0.207099 0.167384 H\n0.522149 0.572980 0.079357 H\n0.627976 0.793648 0.507075 H\n0.200449 0.867904 0.555814 H\n0.150802 0.362346 0.458200 H\n0.531840 0.486124 0.658969 C\n0.421994 0.675421 0.535358 C\n0.344035 0.492842 0.426858 C\n0.210670 0.728905 0.314590 C\n0.086504 0.587545 0.202637 C\n0.367950 0.410141 0.116862 C\n0.240902 0.291820 0.002495 C\n0.969429 0.448982 0.948369 O\n0.748146 0.215329 0.655725 O\n0.420859 0.607907 0.761686 O\n0.401357 0.024023 0.961732 O\n",
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{
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"updated_at": "2022-09-04T14:35:45.274807Z",
"structure_string": "H2 C4\n1.0\n0.000000 -2.461181 0.000000\n0.005860 -0.000000 3.480992\n-6.008481 1.230590 -0.302149\nH C\n2 4\ndirect\n0.048536 0.759826 0.395452 H\n0.653084 0.240173 0.604548 H\n0.408453 0.576042 0.115287 C\n0.293165 0.423957 0.884712 C\n0.961989 0.646657 0.222356 C\n0.739633 0.353342 0.777644 C\n",
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{
"id": "jvasp-112113",
"created_at": "2022-09-04T14:38:41.636366Z",
"updated_at": "2022-09-04T14:38:41.636384Z",
"structure_string": "Cd1 H10 C7 O4\n1.0\n3.754920 0.138088 0.640458\n1.093805 4.366426 0.621918\n0.192280 0.259845 11.352759\nCd H C O\n1 10 7 4\ndirect\n0.945220 0.891851 0.202061 Cd\n0.422936 0.742709 0.548698 H\n0.534753 0.666236 0.778804 H\n0.077603 0.641098 0.822427 H\n0.217079 0.183845 0.707667 H\n0.671786 0.212531 0.657041 H\n0.782478 0.180184 0.902557 H\n0.386310 0.058057 0.910617 H\n0.098310 0.232389 0.508610 H\n0.929254 0.616630 0.440064 H\n-0.027617 0.741164 0.618057 H\n0.478331 0.392179 0.370194 C\n0.168385 0.450993 0.475600 C\n0.240920 0.589640 0.581533 C\n0.386435 0.350033 0.685190 C\n0.364709 0.501246 0.798380 C\n0.479031 0.267559 0.907143 C\n0.324738 0.387758 0.028941 C\n0.136589 0.669113 0.030869 O\n0.490092 0.614967 0.284391 O\n0.710007 0.126541 0.370025 O\n0.380391 0.196026 0.124983 O\n",
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{
"id": "jvasp-103973",
"created_at": "2022-09-04T14:36:39.892846Z",
"updated_at": "2022-09-04T14:36:39.892856Z",
"structure_string": "Cd1 H10 C7 O4\n1.0\n3.769824 -0.515650 -0.261671\n-1.622102 4.388668 -0.152365\n-0.394361 0.008003 11.718275\nCd H C O\n1 10 7 4\ndirect\n0.184325 0.005358 0.195810 Cd\n0.842935 0.189188 0.585880 H\n0.947393 0.240796 0.807147 H\n0.461239 0.385085 0.805519 H\n0.495040 0.852054 0.694469 H\n0.980804 0.708308 0.696057 H\n0.078666 0.758293 0.915652 H\n0.589002 0.917919 0.912375 H\n0.878017 0.662657 0.475941 H\n0.388775 0.806502 0.474634 H\n0.357205 0.334219 0.584153 H\n0.034324 0.384554 0.365285 C\n0.105775 0.582323 0.477101 C\n0.127241 0.412679 0.585589 C\n0.210699 0.628464 0.695316 C\n0.230576 0.463734 0.805512 C\n0.314932 0.686833 0.912890 C\n0.355420 0.551133 0.026825 C\n0.251817 0.253077 0.028766 O\n-0.100250 0.453974 0.271317 O\n0.119778 0.151166 0.369425 O\n0.499828 0.750022 0.118179 O\n",
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{
"id": "jvasp-112179",
"created_at": "2022-09-04T14:38:45.813101Z",
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"structure_string": "Cd1 H10 C7 O4\n1.0\n3.801988 -0.090769 -0.679527\n-1.033444 4.143239 -0.014777\n-0.484409 0.013960 11.781195\nCd H C O\n1 10 7 4\ndirect\n0.245282 0.228645 0.807936 Cd\n0.603463 0.555512 0.409175 H\n0.418876 0.539928 0.182586 H\n0.961778 0.448322 0.199745 H\n0.109476 -0.004938 0.308722 H\n0.569430 0.066579 0.297315 H\n0.324348 0.038934 0.074528 H\n0.866025 0.938645 0.092726 H\n0.833597 0.052819 0.533799 H\n0.401524 0.119580 0.513450 H\n0.148263 0.510832 0.422919 H\n0.482481 0.784933 0.637854 C\n0.541675 0.923711 0.522759 C\n0.401837 0.691861 0.414813 C\n0.323213 0.871531 0.303246 C\n0.198850 0.650474 0.192509 C\n0.092773 0.836114 0.084010 C\n0.960095 0.620276 0.973667 C\n0.697970 0.365643 0.971095 O\n0.631681 0.975184 0.730308 O\n0.273805 0.503532 0.639902 O\n0.116817 0.693703 0.887729 O\n",
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{
"id": "jvasp-112112",
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"structure_string": "Cd1 H10 C7 O4\n1.0\n3.747689 -0.066036 -0.467047\n-0.771591 4.272036 -0.206411\n0.115831 0.025218 11.197997\nCd H C O\n1 10 7 4\ndirect\n0.596912 0.768067 0.800621 Cd\n0.848993 0.552612 0.398370 H\n0.969401 0.516498 0.173523 H\n0.432531 0.518078 0.219853 H\n0.254319 0.032181 0.330832 H\n0.795072 0.027529 0.282938 H\n0.897645 0.973121 0.071509 H\n0.352170 0.971858 0.116625 H\n0.654925 0.030322 0.492187 H\n0.108815 0.041734 0.548625 H\n0.303654 0.544727 0.451509 H\n0.869131 0.370875 0.636676 C\n0.913888 0.192061 0.522304 C\n0.037750 0.393390 0.420656 C\n0.059980 0.186905 0.308258 C\n0.163649 0.364189 0.198334 C\n0.163743 0.130676 0.092143 C\n0.272468 0.254492 0.974663 C\n0.477291 0.522215 0.974480 O\n0.634209 0.250171 0.703248 O\n0.053740 0.649114 0.664157 O\n0.166108 0.067734 0.879259 O\n",
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{
"id": "jvasp-103970",
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"structure_string": "Cd1 H10 C7 O4\n1.0\n3.749029 -0.064285 -0.457072\n-0.772384 4.272012 -0.200783\n0.089709 0.008827 11.199257\nCd H C O\n1 10 7 4\ndirect\n0.214424 0.960671 0.799042 Cd\n0.464503 0.744463 0.396579 H\n0.585082 0.708240 0.171707 H\n0.048408 0.710850 0.217972 H\n0.871735 0.225192 0.329266 H\n0.412237 0.219391 0.281444 H\n0.514668 0.165004 0.069861 H\n0.969220 0.164336 0.115111 H\n0.272822 0.222429 0.490896 H\n0.727160 0.235083 0.547005 H\n0.919640 0.738106 0.449543 H\n0.487018 0.563765 0.635091 C\n0.531488 0.384772 0.520749 C\n0.654117 0.585989 0.418894 C\n0.676793 0.379329 0.306619 C\n0.779840 0.556447 0.196576 C\n0.780545 0.322846 0.090504 C\n0.889582 0.446654 0.973041 C\n0.094420 0.714356 0.972850 O\n0.252191 0.443248 0.701770 O\n0.671847 0.841928 0.662456 O\n0.783534 0.259865 0.877660 O\n",
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{
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"structure_string": "C6 S4 O4\n1.0\n4.414116 -0.089355 -0.200820\n-0.344800 5.024310 -0.371853\n-0.302712 -0.047335 10.424219\nC S O\n6 4 4\ndirect\n0.669943 0.150463 0.204693 C\n0.669945 0.650464 0.704693 C\n0.159960 0.612603 0.804055 C\n0.159961 0.112605 0.304055 C\n0.369931 0.264249 0.223772 C\n0.369934 0.764247 0.723773 C\n0.250384 0.380097 0.892045 S\n0.250383 0.880100 0.392046 S\n0.722035 0.971397 0.074114 S\n0.722037 0.471397 0.574114 S\n0.303338 0.468002 0.175405 O\n0.303340 0.968000 0.675406 O\n0.872379 0.216352 0.308622 O\n0.872379 0.716348 0.808623 O\n",
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